O3-[(1S)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[(1S)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[(1S)-2-(3-chloro-4-methoxy-anilino)-2-oxo-1-phenyl-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(1S)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl] ester O1-methyl ester IUPAC Name: 3-O-[(1S)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(1S)-2-(3-chloro-4-methoxy-anilino)-2-keto-1-phenyl-ethyl] ester O1-methyl ester Formula: C24H19ClN2O8 MolecularWeight: 498.86926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)[C@H](C2=CC=CC=C2)OC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-])Cl

InChI

InChI=1S/C24H19ClN2O8/c1-33-20-9-8-17(13-19(20)25)26-22(28)21(14-6-4-3-5-7-14)35-24(30)16-10-15(23(29)34-2)11-18(12-16)27(31)32/h3-13,21H,1-2H3,(H,26,28)/t21-/m0/s1