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methyl 3-methyl-2-(phenylmethylsulfanyl)benzoate

methyl 3-methyl-2-(phenylmethylsulfanyl)benzoate

Systemtic Name:methyl 3-methyl-2-(phenylmethylsulfanyl)benzoate
Openeye Name:methyl 2-benzylsulfanyl-3-methyl-benzoate
CAS Name:3-methyl-2-(phenylmethylthio)benzoic acid methyl ester
IUPAC Name:methyl 2-benzylsulfanyl-3-methylbenzoate
Traditional Name:2-(benzylthio)-3-methyl-benzoic acid methyl ester
Formula: C16H16O2S
MolecularWeight: 272.36204
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1SCC2=CC=CC=C2)C(=O)OC


Isomeric SMILES

CC1=CC=CC(=C1SCC2=CC=CC=C2)C(=O)OC


InChI

InChI=1S/C16H16O2S/c1-12-7-6-10-14(16(17)18-2)15(12)19-11-13-8-4-3-5-9-13/h3-10H,11H2,1-2H3


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