phenyl 2-methyl-4-sulfanyl-butanoate

Systemtic Name: phenyl 2-methyl-4-sulfanyl-butanoate Openeye Name: phenyl 2-methyl-4-sulfanyl-butanoate CAS Name: 4-mercapto-2-methylbutanoic acid phenyl ester IUPAC Name: phenyl 2-methyl-4-sulfanylbutanoate Traditional Name: 4-mercapto-2-methyl-butyric acid phenyl ester Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCS)C(=O)OC1=CC=CC=C1

Isomeric SMILES

CC(CCS)C(=O)OC1=CC=CC=C1

InChI

InChI=1S/C11H14O2S/c1-9(7-8-14)11(12)13-10-5-3-2-4-6-10/h2-6,9,14H,7-8H2,1H3