[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 2-nitrobenzoate

Systemtic Name: [2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 2-nitrobenzoate Openeye Name: [2-(o-tolylmethylamino)-2-oxo-ethyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [2-[(2-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylphenyl)methylamino]-2-oxoethyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)COC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)COC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5/c1-12-6-2-3-7-13(12)10-18-16(20)11-24-17(21)14-8-4-5-9-15(14)19(22)23/h2-9H,10-11H2,1H3,(H,18,20)