2-(4-acetamidophenyl)sulfanylethyl benzoate

Systemtic Name: 2-(4-acetamidophenyl)sulfanylethyl benzoate Openeye Name: 2-(4-acetamidophenyl)sulfanylethyl benzoate CAS Name: benzoic acid 2-[(4-acetamidophenyl)thio]ethyl ester IUPAC Name: 2-(4-acetamidophenyl)sulfanylethyl benzoate Traditional Name: benzoic acid 2-[(4-acetamidophenyl)thio]ethyl ester Formula: C17H17NO3S MolecularWeight: 315.38678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCCOC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCCOC(=O)C2=CC=CC=C2

InChI

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