methyl 2,2,3-trimethyl-3-[(4-methylphenyl)sulfanylmethyl]hex-5-enoate

Systemtic Name: methyl 2,2,3-trimethyl-3-[(4-methylphenyl)sulfanylmethyl]hex-5-enoate Openeye Name: methyl 2,2,3-trimethyl-3-(p-tolylsulfanylmethyl)hex-5-enoate CAS Name: 2,2,3-trimethyl-3-[[(4-methylphenyl)thio]methyl]-5-hexenoic acid methyl ester IUPAC Name: methyl 2,2,3-trimethyl-3-[(4-methylphenyl)sulfanylmethyl]hex-5-enoate Traditional Name: 2,2,3-trimethyl-3-[(p-tolylthio)methyl]hex-5-enoic acid methyl ester Formula: C18H26O2S MolecularWeight: 306.46284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26O2S/c1-7-12-18(5,17(3,4)16(19)20-6)13-21-15-10-8-14(2)9-11-15/h7-11H,1,12-13H2,2-6H3