methyl 2-[2-[phenyl(sulfanyl)methyl]phenyl]ethanoate

Systemtic Name: methyl 2-[2-[phenyl(sulfanyl)methyl]phenyl]ethanoate Openeye Name: methyl 2-[2-[phenyl(sulfanyl)methyl]phenyl]acetate CAS Name: 2-[2-[mercapto(phenyl)methyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[phenyl(sulfanyl)methyl]phenyl]acetate Traditional Name: 2-[2-[mercapto(phenyl)methyl]phenyl]acetic acid methyl ester Formula: C16H16O2S MolecularWeight: 272.36204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=CC=C1C(C2=CC=CC=C2)S

Isomeric SMILES

COC(=O)CC1=CC=CC=C1C(C2=CC=CC=C2)S

InChI

InChI=1S/C16H16O2S/c1-18-15(17)11-13-9-5-6-10-14(13)16(19)12-7-3-2-4-8-12/h2-10,16,19H,11H2,1H3