[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl] 3-nitrobenzoate

Systemtic Name: [2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl] 3-nitrobenzoate Openeye Name: [2-(4-isopropylanilino)-2-oxo-ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-oxo-2-(4-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-propan-2-ylanilino)ethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-cumidino-2-keto-ethyl) ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O5/c1-12(2)13-6-8-15(9-7-13)19-17(21)11-25-18(22)14-4-3-5-16(10-14)20(23)24/h3-10,12H,11H2,1-2H3,(H,19,21)