[2-oxidanylidene-2-[(3-quinoxalin-2-ylphenyl)amino]ethyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[(3-quinoxalin-2-ylphenyl)amino]ethyl] 3-methyl-4-nitro-benzoate Openeye Name: [2-oxo-2-(3-quinoxalin-2-ylanilino)ethyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [2-oxo-2-[3-(2-quinoxalinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(3-quinoxalin-2-ylanilino)ethyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [2-keto-2-(3-quinoxalin-2-ylanilino)ethyl] ester Formula: C24H18N4O5 MolecularWeight: 442.42352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4N=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4N=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H18N4O5/c1-15-11-17(9-10-22(15)28(31)32)24(30)33-14-23(29)26-18-6-4-5-16(12-18)21-13-25-19-7-2-3-8-20(19)27-21/h2-13H,14H2,1H3,(H,26,29)