ethyl 2-[(4-nitrophenyl)carbonylamino]-7-oxidanylidene-5,6-dihydro-4H-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-nitrophenyl)carbonylamino]-7-oxidanylidene-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(4-nitrobenzoyl)amino]-7-oxo-5,6-dihydro-4H-benzothiophene-3-carboxylate CAS Name: 2-[[(4-nitrophenyl)-oxomethyl]amino]-7-oxo-5,6-dihydro-4H-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-nitrobenzoyl)amino]-7-oxo-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Traditional Name: 7-keto-2-[(4-nitrobenzoyl)amino]-5,6-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester Formula: C18H16N2O6S MolecularWeight: 388.39444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O6S/c1-2-26-18(23)14-12-4-3-5-13(21)15(12)27-17(14)19-16(22)10-6-8-11(9-7-10)20(24)25/h6-9H,2-5H2,1H3,(H,19,22)