[2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 4-nitrobenzoate

Systemtic Name: [2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 4-nitrobenzoate Openeye Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-oxo-2-(1-phenylbutylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-keto-2-(1-phenylbutylamino)ethyl] ester Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O5/c1-2-6-17(14-7-4-3-5-8-14)20-18(22)13-26-19(23)15-9-11-16(12-10-15)21(24)25/h3-5,7-12,17H,2,6,13H2,1H3,(H,20,22)