methyl 4-[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-(2-cyanoanilino)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-(2-cyanoanilino)-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-(2-cyanoanilino)-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-(2-cyanoanilino)-2-keto-ethoxy]-3-nitro-benzoic acid methyl ester Formula: C17H13N3O6 MolecularWeight: 355.30162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC=C2C#N)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC=C2C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O6/c1-25-17(22)11-6-7-15(14(8-11)20(23)24)26-10-16(21)19-13-5-3-2-4-12(13)9-18/h2-8H,10H2,1H3,(H,19,21)