Vitas-M small molecule compound

(2E)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one

Catalog ID
STK437763
SMILES CCOc1ccccc1N1CCN(CC1)C(=O)/C=C/c1cccc(c1)[N+](=O)[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 C21H23N3O4 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4/c1-2-28-20-9-4-3-8-19(20)22-12-14-23(15-13-22)21(25)11-10-17-6-5-7-18(16-17)24(26)27/h3-11,16H,2,12-15H2,1H3/b11-10+
InChIKey
IRKUYQXRVRPUOQ-ZHACJKMWSA-N
Synonyms

(2E)1(4(2ethoxyphenyl)piperazin1yl)3(3nitrophenyl)prop2en1one
(2E)1(4(2ETHOXYPHENYL)PIPERAZINYL)3(3NITROPHENYL)PROP2EN1ONE
(E)1(4(2ETHOXYPHENYL)PIPERAZIN1YL)3(3NITROPHENYL)PROP2EN1ONE
1(2ETHOXYPHENYL)4(3(3NITROPHENYL)ACRYLOYL)PIPERAZINE
CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C=CC3=CC(=CC=C3)(N+)(=O)(O)
CCOc1ccccc1N1CCN(CC1)C(=O)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC21H23N3O4c122820943819(20)22121423(151322)21(25)11101765718(1617)24(26)27h31116H21215H21H3b1110+
MFCD01338178
ZINC000000995095
ZINC00995095
ZINC995095

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Available files

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