Vitas-M small molecule compound
2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl 2-(4-bromophenyl)-6-methylquinoline-4-carboxylate
Catalog ID
STK290186
SMILES Cc1ccc2c(c1)c(cc(n2)c1ccc(cc1)Br)C(=O)OCC(=O)c1ccc(cc1)Oc1ccc(cc1)[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 C31H21BrN2O6 MW 597.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H21BrN2O6/c1-19-2-15-28-26(16-19)27(17-29(33-28)20-3-7-22(32)8-4-20)31(36)39-18-30(35)21-5-11-24(12-6-21)40-25-13-9-23(10-14-25)34(37)38/h2-17H,18H2,1H3InChIKey
NOPYYEDIGATLNC-UHFFFAOYSA-NSynonyms
(2(4(4nitrophenoxy)phenyl)2oxoethyl)2(4bromophenyl)6methylquinoline4carboxylate
2(4(4nitrophenoxy)phenyl)2oxoethyl2(4bromophenyl)6methylquinoline4carboxylate
CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)(N+)(=O)(O))C5=CC=C(C=C5)Br
Cc1ccc2c(c1)c(cc(n2)c1ccc(cc1)Br)C(=O)OCC(=O)c1ccc(cc1)Oc1ccc(cc1)(N+)(=O)(O)
InChI=1SC31H21BrN2O6c1192152826(1619)27(1729(3328)203722(32)8420)31(36)391830(35)2151124(12621)402513923(101425)34(37)38h217H18H21H3
MFCD06756118
ZINC000097948710
ZINC97948710
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