(3-methylphenyl) 2-[(4-methylphenyl)methylsulfanyl]propanoate

Systemtic Name: (3-methylphenyl) 2-[(4-methylphenyl)methylsulfanyl]propanoate Openeye Name: m-tolyl 2-(p-tolylmethylsulfanyl)propanoate CAS Name: 2-[(4-methylphenyl)methylthio]propanoic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 2-[(4-methylphenyl)methylsulfanyl]propanoate Traditional Name: 2-[(4-methylbenzyl)thio]propionic acid m-tolyl ester Formula: C18H20O2S MolecularWeight: 300.4152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC(C)C(=O)OC2=CC=CC(=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC(C)C(=O)OC2=CC=CC(=C2)C

InChI

InChI=1S/C18H20O2S/c1-13-7-9-16(10-8-13)12-21-15(3)18(19)20-17-6-4-5-14(2)11-17/h4-11,15H,12H2,1-3H3