(3-aminophenyl)methylsulfanyl ethanoate hydrochloride

Systemtic Name: (3-aminophenyl)methylsulfanyl ethanoate hydrochloride Openeye Name: (3-aminophenyl)methylsulfanyl acetate hydrochloride CAS Name: acetic acid [(3-aminophenyl)methylthio] ester hydrochloride IUPAC Name: (3-aminophenyl)methylsulfanyl acetate hydrochloride Traditional Name: acetic acid [(3-aminobenzyl)thio] ester hydrochloride Formula: C9H12ClNO2S MolecularWeight: 233.71508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OSCC1=CC(=CC=C1)N.Cl

Isomeric SMILES

CC(=O)OSCC1=CC(=CC=C1)N.Cl

InChI

InChI=1S/C9H11NO2S.ClH/c1-7(11)12-13-6-8-3-2-4-9(10)5-8;/h2-5H,6,10H2,1H3;1H