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

Systemtic Name: ethyl 7-chloranyl-6-methanoyl-2-[(4-nitrophenyl)carbonylamino]-4,5-dihydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 7-chloro-6-formyl-2-[(4-nitrobenzoyl)amino]-4,5-dihydrobenzothiophene-3-carboxylate CAS Name: 7-chloro-6-formyl-2-[[(4-nitrophenyl)-oxomethyl]amino]-4,5-dihydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-6-formyl-2-[(4-nitrobenzoyl)amino]-4,5-dihydro-1-benzothiophene-3-carboxylate Traditional Name: 7-chloro-6-formyl-2-[(4-nitrobenzoyl)amino]-4,5-dihydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C19H15ClN2O6S MolecularWeight: 434.8502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(=C2Cl)C=O)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(=C2Cl)C=O)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15ClN2O6S/c1-2-28-19(25)14-13-8-5-11(9-23)15(20)16(13)29-18(14)21-17(24)10-3-6-12(7-4-10)22(26)27/h3-4,6-7,9H,2,5,8H2,1H3,(H,21,24)