O-methyl 2,2-dimethyl-4-oxidanylidene-5-phenyl-pentanethioate

Systemtic Name: O-methyl 2,2-dimethyl-4-oxidanylidene-5-phenyl-pentanethioate Openeye Name: O-methyl 2,2-dimethyl-4-oxo-5-phenyl-pentanethioate CAS Name: 2,2-dimethyl-4-oxo-5-phenylpentanethioic acid O-methyl ester IUPAC Name: O-methyl 2,2-dimethyl-4-oxo-5-phenylpentanethioate Traditional Name: 4-keto-2,2-dimethyl-5-phenyl-pentanethioic acid O-methyl ester Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)CC1=CC=CC=C1)C(=S)OC

Isomeric SMILES

CC(C)(CC(=O)CC1=CC=CC=C1)C(=S)OC

InChI

InChI=1S/C14H18O2S/c1-14(2,13(17)16-3)10-12(15)9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3