Vitas-M small molecule compound
ethyl 1,2-dimethyl-5-{[(4-nitrophenyl)carbonyl]oxy}-1H-indole-3-carboxylate
Catalog ID
STK869638
SMILES CCOC(=O)c1c(C)n(c2c1cc(cc2)OC(=O)c1ccc(cc1)[N+](=O)[O-])C
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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 C20H18N2O6 MW 382.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O6/c1-4-27-20(24)18-12(2)21(3)17-10-9-15(11-16(17)18)28-19(23)13-5-7-14(8-6-13)22(25)26/h5-11H,4H2,1-3H3InChIKey
KWRBWVCCMUBCKI-UHFFFAOYSA-NSynonyms
312528-45-312DIMETHYL5(4NITROBENZOYLOXY)1HINDOLE3CARBOXYLICACIDETHYLESTER
312528453
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O))C)C
CCOC(=O)c1c(C)n(c2c1cc(cc2)OC(=O)c1ccc(cc1)(N+)(=O)(O))C
ethyl12dimethyl5(((4nitrophenyl)carbonyl)oxy)1Hindole3carboxylate
ethyl12dimethyl5((4nitrobenzoyl)oxy)1Hindole3carboxylate
ETHYL12DIMETHYL5(4NITROBENZOYL)OXYINDOLE3CARBOXYLATE
InChI=1SC20H18N2O6c142720(24)1812(2)21(3)1710915(1116(17)18)2819(23)135714(8613)22(25)26h511H4H213H3
MFCD01646423
ZINC000004808665
ZINC04808665
ZINC4808665
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