(3-acetamidophenyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: (3-acetamidophenyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: (3-acetamidophenyl) 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid (3-acetamidophenyl) ester IUPAC Name: (3-acetamidophenyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid (3-acetamidophenyl) ester Formula: C17H17NO3S MolecularWeight: 315.38678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)OC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)OC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C17H17NO3S/c1-11(19)18-13-6-4-7-14(10-13)21-17(20)16-9-12-5-2-3-8-15(12)22-16/h4,6-7,9-10H,2-3,5,8H2,1H3,(H,18,19)