Vitas-M small molecule compound
2-(4-methoxy-3-nitrophenyl)-2-oxoethyl 2-(4-methoxyphenyl)-8-methylquinoline-4-carboxylate
Catalog ID
STK380275
SMILES COc1ccc(cc1)c1cc(C(=O)OCC(=O)c2ccc(c(c2)[N+](=O)[O-])OC)c2c(n1)c(C)ccc2
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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 C27H22N2O7 MW 486.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O7/c1-16-5-4-6-20-21(14-22(28-26(16)20)17-7-10-19(34-2)11-8-17)27(31)36-15-24(30)18-9-12-25(35-3)23(13-18)29(32)33/h4-14H,15H2,1-3H3InChIKey
OTQMACGKJLFEBE-UHFFFAOYSA-NSynonyms
(2(4METHOXY3NITROPHENYL)2OXOETHYL)2(4METHOXYPHENYL)8METHYLQUINOLINE4CARBOXYLATE
2(4methoxy3nitrophenyl)2oxoethyl2(4methoxyphenyl)8methylquinoline4carboxylate
CC1=CC=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC(=C(C=C3)OC)(N+)(=O)(O))C4=CC=C(C=C4)OC
COc1ccc(cc1)c1cc(C(=O)OCC(=O)c2ccc(c(c2)(N+)(=O)(O))OC)c2c(n1)c(C)ccc2
InChI=1SC27H22N2O7c1165462021(1422(2826(16)20)1771019(342)11817)27(31)361524(30)1891225(353)23(1318)29(32)33h414H15H213H3
MFCD02104280
ZINC000001170897
ZINC01170897
ZINC1170897
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