Vitas-M small molecule compound

2-(3-nitrophenyl)-2-oxoethyl 1,3-dioxo-2-[3-(quinoxalin-2-yl)phenyl]-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK389004
SMILES O=C1c2cc(ccc2C(=O)N1c1cccc(c1)c1cnc2c(n1)cccc2)C(=O)OCC(=O)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 C31H18N4O7 MW 558.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H18N4O7/c36-28(19-6-4-8-22(14-19)35(40)41)17-42-31(39)20-11-12-23-24(15-20)30(38)34(29(23)37)21-7-3-5-18(13-21)27-16-32-25-9-1-2-10-26(25)33-27/h1-16H,17H2
InChIKey
CNNOKXNOWGZSAC-UHFFFAOYSA-N
Synonyms
519041-82-8
(2(3NITROPHENYL)2OXOETHYL)13DIOXO2(3QUINOXALIN2YLPHENYL)ISOINDOLE5CARBOXYLATE
2(3nitrophenyl)2oxoethyl13dioxo2(3(quinoxalin2yl)phenyl)23dihydro1Hisoindole5carboxylate
2(3nitrophenyl)2oxoethyl13dioxo2(3(quinoxalin2yl)phenyl)isoindoline5carboxylate
519041828
C1=CC=C2C(=C1)N=CC(=N2)C3=CC(=CC=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)OCC(=O)C6=CC(=CC=C6)(N+)(=O)(O)
InChI=1SC31H18N4O7c3628(1964822(1419)35(40)41)174231(39)2011122324(1520)30(38)34(29(23)37)2173518(1321)271632259121026(25)3327h116H17H2
MFCD03103106
O=C1c2cc(ccc2C(=O)N1c1cccc(c1)c1cnc2c(n1)cccc2)C(=O)OCC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000001875358
ZINC01875358
ZINC1875358

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Available files

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