[2-oxidanylidene-2-[[4-[phenyl(propan-2-yl)amino]phenyl]amino]ethyl] 4-nitrobenzoate

Systemtic Name: [2-oxidanylidene-2-[[4-[phenyl(propan-2-yl)amino]phenyl]amino]ethyl] 4-nitrobenzoate Openeye Name: [2-[4-(N-isopropylanilino)anilino]-2-oxo-ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-oxo-2-[4-(N-propan-2-ylanilino)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[4-(N-propan-2-ylanilino)anilino]ethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-[4-(N-isopropylanilino)anilino]-2-keto-ethyl] ester Formula: C24H23N3O5 MolecularWeight: 433.45652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)NC(=O)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)NC(=O)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O5/c1-17(2)26(20-6-4-3-5-7-20)21-14-10-19(11-15-21)25-23(28)16-32-24(29)18-8-12-22(13-9-18)27(30)31/h3-15,17H,16H2,1-2H3,(H,25,28)