methyl 3,3-dimethyl-4-phenylsulfanyl-hex-5-enoate

Systemtic Name: methyl 3,3-dimethyl-4-phenylsulfanyl-hex-5-enoate Openeye Name: methyl 3,3-dimethyl-4-phenylsulfanyl-hex-5-enoate CAS Name: 3,3-dimethyl-4-(phenylthio)-5-hexenoic acid methyl ester IUPAC Name: methyl 3,3-dimethyl-4-phenylsulfanylhex-5-enoate Traditional Name: 3,3-dimethyl-4-(phenylthio)hex-5-enoic acid methyl ester Formula: C15H20O2S MolecularWeight: 264.3831

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)OC)C(C=C)SC1=CC=CC=C1

Isomeric SMILES

CC(C)(CC(=O)OC)C(C=C)SC1=CC=CC=C1

InChI

InChI=1S/C15H20O2S/c1-5-13(15(2,3)11-14(16)17-4)18-12-9-7-6-8-10-12/h5-10,13H,1,11H2,2-4H3