[2-[(2-bromanyl-4-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-(diphenylamino)ethanoate

Systemtic Name: [2-[(2-bromanyl-4-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-(diphenylamino)ethanoate Openeye Name: [2-(2-bromo-4-nitro-anilino)-2-oxo-1-phenyl-ethyl] 2-(N-phenylanilino)acetate CAS Name: 2-(N-phenylanilino)acetic acid [2-(2-bromo-4-nitroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(2-bromo-4-nitroanilino)-2-oxo-1-phenylethyl] 2-(N-phenylanilino)acetate Traditional Name: 2-(N-phenylanilino)acetic acid [2-(2-bromo-4-nitro-anilino)-2-keto-1-phenyl-ethyl] ester Formula: C28H22BrN3O5 MolecularWeight: 560.39538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)OC(=O)CN(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)OC(=O)CN(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H22BrN3O5/c29-24-18-23(32(35)36)16-17-25(24)30-28(34)27(20-10-4-1-5-11-20)37-26(33)19-31(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-18,27H,19H2,(H,30,34)