methyl 2-[[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate

Systemtic Name: methyl 2-[[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate Openeye Name: methyl 2-[[2-(2-methyl-5-nitro-anilino)-2-oxo-ethyl]amino]benzoate CAS Name: 2-[[2-(2-methyl-5-nitroanilino)-2-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(2-methyl-5-nitroanilino)-2-oxoethyl]amino]benzoate Traditional Name: 2-[[2-keto-2-(2-methyl-5-nitro-anilino)ethyl]amino]benzoic acid methyl ester Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CNC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CNC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C17H17N3O5/c1-11-7-8-12(20(23)24)9-15(11)19-16(21)10-18-14-6-4-3-5-13(14)17(22)25-2/h3-9,18H,10H2,1-2H3,(H,19,21)