Vitas-M small molecule compound
2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl 6-bromo-8-methyl-2-phenylquinoline-4-carboxylate
Catalog ID
STK290206
SMILES Brc1cc(C)c2c(c1)c(cc(n2)c1ccccc1)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/c1-19-15-22(32)16-26-27(17-28(33-30(19)26)20-5-3-2-4-6-20)31(36)39-18-29(35)21-7-11-24(12-8-21)40-25-13-9-23(10-14-25)34(37)38/h2-17H,18H2,1H3InChIKey
GJXQNVKYJCLLME-UHFFFAOYSA-NSynonyms
(2(4(4NITROPHENOXY)PHENYL)2OXOETHYL)6BROMO8METHYL2PHENYLQUINOLINE4CARBOXYLATE
2(4(4nitrophenoxy)phenyl)2oxoethyl6bromo8methyl2phenylquinoline4carboxylate
Brc1cc(C)c2c(c1)c(cc(n2)c1ccccc1)C(=O)OCC(=O)c1ccc(cc1)Oc1ccc(cc1)(N+)(=O)(O)
CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC31H21BrN2O6c1191522(32)162627(1728(3330(19)26)205324620)31(36)391829(35)2171124(12821)402513923(101425)34(37)38h217H18H21H3
MFCD04078382
ZINC000100397015
ZINC100397015
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