(4-aminocarbonylphenyl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)OCC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)OCC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C17H17NO3S/c18-16(19)12-7-5-11(6-8-12)9-21-17(20)14-10-22-15-4-2-1-3-13(14)15/h5-8,10H,1-4,9H2,(H2,18,19)