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(2Z)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-2-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate

Catalog ID
STK582008
SMILES OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\C=C\c1ccccc1OC)/C2=O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C25H28N2O5 MW 436.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O5/c1-31-22-7-3-2-5-18(22)6-4-8-23-24(30)19-9-10-21(29)20(25(19)32-23)17-27-13-11-26(12-14-27)15-16-28/h2-10,28-29H,11-17H2,1H3/b6-4+,23-8-
InChIKey
DGBDTVNISBOCDB-YUMLRZHGSA-N
Synonyms
1164522-04-6
(2Z)6HYDROXY7((4(2HYDROXYETHYL)1PIPERAZINYL)METHYL)2((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)3BENZOFURANONE
(2Z)6HYDROXY7((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)2((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)1BENZOFURAN3ONE
(2Z)6HYDROXY7((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)2((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)BENZOFURAN3ONE
(2Z)6HYDROXY7((4(2HYDROXYETHYL)PIPERAZINO)METHYL)2((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)COUMARAN3ONE
(2Z)7((4(2hydroxyethyl)piperazin1ium1yl)methyl)2((2E)3(2methoxyphenyl)prop2en1ylidene)3oxo23dihydro1benzofuran6olate
(2Z)7((4(2hydroxyethyl)piperazin1ium1yl)methyl)2((E)3(2methoxyphenyl)prop2enylidene)3oxo1benzofuran6olate
(2Z)7((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)2((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)6OXIDANYL1BENZOFURAN3ONE
2((2E)3(2METHOXYPHENYL)PROP2ENYLIDENE)6HYDROXY7((4(2HYDROXYETHYL)PIPERAZINYL)METHYL)BENZO(B)FURAN3ONE
6HYDROXY7(4(2HYDROXYETHYL)PIPERAZIN1YLMETHYL)2((E)3(2METHOXYPHENYL)PROP2EN(Z)YLIDENE)BENZOFURAN3ONE
COC1=CC=CC=C1C=CC=C2C(=O)C3=C(O2)C(=C(C=C3)(O))C(NH+)4CCN(CC4)CCO
InChI=1SC25H28N2O5c13122732518(22)6482324(30)1991021(29)20(25(19)3223)1727131126(121427)151628h2102829H1117H21H3b64+238
MFCD06608412
OCCN1CC(NH+)(CC1)Cc1c((O))ccc2c1OC(=CC=Cc1ccccc1OC)C2=O
ZINC000020533280
ZINC20533280

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Available files

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