ethyl 5-(dimethylaminomethylidene)-2-[(4-nitrophenyl)amino]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl 5-(dimethylaminomethylidene)-2-[(4-nitrophenyl)amino]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl 5-(dimethylaminomethylene)-2-(4-nitroanilino)-4-oxo-thiophene-3-carboxylate CAS Name: 5-(dimethylaminomethylidene)-2-(4-nitroanilino)-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(dimethylaminomethylidene)-2-(4-nitroanilino)-4-oxothiophene-3-carboxylate Traditional Name: 5-(dimethylaminomethylene)-4-keto-2-(4-nitroanilino)thiophene-3-carboxylic acid ethyl ester Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=CN(C)C)C1=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=CN(C)C)C1=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O5S/c1-4-24-16(21)13-14(20)12(9-18(2)3)25-15(13)17-10-5-7-11(8-6-10)19(22)23/h5-9,17H,4H2,1-3H3