ethyl 7-hydroxyimino-3-(pentanoylamino)-5,6-dihydro-4H-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 7-hydroxyimino-3-(pentanoylamino)-5,6-dihydro-4H-1-benzothiophene-2-carboxylate Openeye Name: ethyl 7-hydroxyimino-3-(pentanoylamino)-5,6-dihydro-4H-benzothiophene-2-carboxylate CAS Name: 7-hydroxyimino-3-(1-oxopentylamino)-5,6-dihydro-4H-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-hydroxyimino-3-(pentanoylamino)-5,6-dihydro-4H-1-benzothiophene-2-carboxylate Traditional Name: 7-hydroximino-3-(valerylamino)-5,6-dihydro-4H-benzothiophene-2-carboxylic acid ethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(SC2=C1CCCC2=NO)C(=O)OCC

Isomeric SMILES

CCCCC(=O)NC1=C(SC2=C1CCCC2=NO)C(=O)OCC

InChI

InChI=1S/C16H22N2O4S/c1-3-5-9-12(19)17-13-10-7-6-8-11(18-21)14(10)23-15(13)16(20)22-4-2/h21H,3-9H2,1-2H3,(H,17,19)