Vitas-M small molecule compound
3-(2-bromophenoxy)-2-methyl-4-oxo-8-(pyrrolidinium-1-ylmethyl)-4H-chromen-7-olate
Catalog ID
STK597760
SMILES Cc1oc2c(C[NH+]3CCCC3)c([O-])ccc2c(=O)c1Oc1ccccc1Br
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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 C21H20BrNO4 MW 430.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrNO4/c1-13-20(27-18-7-3-2-6-16(18)22)19(25)14-8-9-17(24)15(21(14)26-13)12-23-10-4-5-11-23/h2-3,6-9,24H,4-5,10-12H2,1H3InChIKey
USFJVBRAPROLHJ-UHFFFAOYSA-NSynonyms
844645-73-43(2BROMANYLPHENOXY)2METHYL7OXIDANYL8(PYRROLIDIN1YLMETHYL)CHROMEN4ONE
3(2bromophenoxy)2methyl4oxo8(pyrrolidin1ium1ylmethyl)chromen7olate
3(2bromophenoxy)2methyl4oxo8(pyrrolidinium1ylmethyl)4Hchromen7olate
3(2BROMOPHENOXY)7HYDROXY2METHYL8(1PYRROLIDINYLMETHYL)1BENZOPYRAN4ONE
3(2BROMOPHENOXY)7HYDROXY2METHYL8(PYRROLIDIN1YLMETHYL)CHROMEN4ONE
3(2BROMOPHENOXY)7HYDROXY2METHYL8(PYRROLIDINOMETHYL)CHROMONE
3(2BROMOPHENOXY)7HYDROXY2METHYL8(PYRROLIDINYLMETHYL)CHROMEN4ONE
CC1=C(C(=O)C2=C(O1)C(=C(C=C2)(O))C(NH+)3CCCC3)OC4=CC=CC=C4Br
Cc1oc2c(C(NH+)3CCCC3)c((O))ccc2c(=O)c1Oc1ccccc1Br
InChI=1SC21H20BrNO4c11320(2718732616(18)22)19(25)148917(24)15(21(14)2613)122310451123h236924H451012H21H3
MFCD04158081
ZINC000006498958
ZINC6498958
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