[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 2,3-bis(p-tolyl)quinoxaline-6-carboxylate CAS Name: 2,3-bis(4-methylphenyl)-6-quinoxalinecarboxylic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate Traditional Name: 2,3-bis(p-tolyl)quinoxaline-6-carboxylic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C31H23N3O5 MolecularWeight: 517.53142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(=O)OCC(=O)C4=CC(=CC=C4)[N+](=O)[O-])N=C2C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(=O)OCC(=O)C4=CC(=CC=C4)[N+](=O)[O-])N=C2C5=CC=C(C=C5)C

InChI

InChI=1S/C31H23N3O5/c1-19-6-10-21(11-7-19)29-30(22-12-8-20(2)9-13-22)33-27-17-24(14-15-26(27)32-29)31(36)39-18-28(35)23-4-3-5-25(16-23)34(37)38/h3-17H,18H2,1-2H3