ethyl 2-(4-chlorophenyl)carbonylimino-7-(oxidanylamino)-5,6-dihydro-4H-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-(4-chlorophenyl)carbonylimino-7-(oxidanylamino)-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(4-chlorobenzoyl)imino-7-(hydroxyamino)-5,6-dihydro-4H-benzothiophene-3-carboxylate CAS Name: 2-[(4-chlorophenyl)-oxomethyl]imino-7-(hydroxyamino)-5,6-dihydro-4H-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorobenzoyl)imino-7-(hydroxyamino)-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Traditional Name: 2-(4-chlorobenzoyl)imino-7-(hydroxyamino)-5,6-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester Formula: C18H17ClN2O4S MolecularWeight: 392.85658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCCC(=C2SC1=NC(=O)C3=CC=C(C=C3)Cl)NO

Isomeric SMILES

CCOC(=O)C1=C2CCCC(=C2SC1=NC(=O)C3=CC=C(C=C3)Cl)NO

InChI

InChI=1S/C18H17ClN2O4S/c1-2-25-18(23)14-12-4-3-5-13(21-24)15(12)26-17(14)20-16(22)10-6-8-11(19)9-7-10/h6-9,21,24H,2-5H2,1H3