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

Systemtic Name: [2-[(2-bromanyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(diphenylamino)ethanoate Openeye Name: [2-(2-bromo-4-nitro-anilino)-2-oxo-ethyl] 2-(N-phenylanilino)acetate CAS Name: 2-(N-phenylanilino)acetic acid [2-(2-bromo-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-nitroanilino)-2-oxoethyl] 2-(N-phenylanilino)acetate Traditional Name: 2-(N-phenylanilino)acetic acid [2-(2-bromo-4-nitro-anilino)-2-keto-ethyl] ester Formula: C22H18BrN3O5 MolecularWeight: 484.29942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18BrN3O5/c23-19-13-18(26(29)30)11-12-20(19)24-21(27)15-31-22(28)14-25(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-13H,14-15H2,(H,24,27)