[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2-methyl-3-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2-methyl-3-nitro-benzoate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OCC(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OCC(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C19H20N2O5/c1-14-16(10-5-11-17(14)21(24)25)19(23)26-13-18(22)20-12-6-9-15-7-3-2-4-8-15/h2-5,7-8,10-11H,6,9,12-13H2,1H3,(H,20,22)