7-[ethanoyl(phenyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-6-carboxylic acid

Systemtic Name: 7-[ethanoyl(phenyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-6-carboxylic acid Openeye Name: 7-(N-acetylanilino)-4,5,6,7-tetrahydrobenzothiophene-6-carboxylic acid CAS Name: 7-(N-acetylanilino)-4,5,6,7-tetrahydro-1-benzothiophene-6-carboxylic acid IUPAC Name: 7-(N-acetylanilino)-4,5,6,7-tetrahydro-1-benzothiophene-6-carboxylic acid Traditional Name: 7-(N-acetylanilino)-4,5,6,7-tetrahydrobenzothiophene-6-carboxylic acid Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1C(CCC2=C1SC=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N(C1C(CCC2=C1SC=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C17H17NO3S/c1-11(19)18(13-5-3-2-4-6-13)15-14(17(20)21)8-7-12-9-10-22-16(12)15/h2-6,9-10,14-15H,7-8H2,1H3,(H,20,21)