[2-oxidanylidene-2-[phenyl(prop-2-enyl)amino]ethyl] 2-methoxy-5-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[phenyl(prop-2-enyl)amino]ethyl] 2-methoxy-5-nitro-benzoate Openeye Name: [2-(N-allylanilino)-2-oxo-ethyl] 2-methoxy-5-nitro-benzoate CAS Name: 2-methoxy-5-nitrobenzoic acid [2-oxo-2-(N-prop-2-enylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(N-prop-2-enylanilino)ethyl] 2-methoxy-5-nitrobenzoate Traditional Name: 2-methoxy-5-nitro-benzoic acid [2-(N-allylanilino)-2-keto-ethyl] ester Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC(=O)N(CC=C)C2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC(=O)N(CC=C)C2=CC=CC=C2

InChI

InChI=1S/C19H18N2O6/c1-3-11-20(14-7-5-4-6-8-14)18(22)13-27-19(23)16-12-15(21(24)25)9-10-17(16)26-2/h3-10,12H,1,11,13H2,2H3