ethyl 3-methyl-2-(4-nitrophenyl)-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylate

Systemtic Name: ethyl 3-methyl-2-(4-nitrophenyl)-4-oxidanylidene-7H-thieno[2,3-b]pyridine-5-carboxylate Openeye Name: ethyl 3-methyl-2-(4-nitrophenyl)-4-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate CAS Name: 3-methyl-2-(4-nitrophenyl)-4-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-2-(4-nitrophenyl)-4-oxo-7H-thieno[2,3-b]pyridine-5-carboxylate Traditional Name: 4-keto-3-methyl-2-(4-nitrophenyl)-7H-thieno[2,3-b]pyridine-5-carboxylic acid ethyl ester Formula: C17H14N2O5S MolecularWeight: 358.36846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C1=O)C(=C(S2)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C1=O)C(=C(S2)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C17H14N2O5S/c1-3-24-17(21)12-8-18-16-13(14(12)20)9(2)15(25-16)10-4-6-11(7-5-10)19(22)23/h4-8H,3H2,1-2H3,(H,18,20)