methyl (E)-6-(2-methoxy-3,4-dimethyl-5-methylsulfanyl-phenyl)-4-methyl-hex-4-enoate

Systemtic Name: methyl (E)-6-(2-methoxy-3,4-dimethyl-5-methylsulfanyl-phenyl)-4-methyl-hex-4-enoate Openeye Name: methyl (E)-6-(2-methoxy-3,4-dimethyl-5-methylsulfanyl-phenyl)-4-methyl-hex-4-enoate CAS Name: (E)-6-[2-methoxy-3,4-dimethyl-5-(methylthio)phenyl]-4-methyl-4-hexenoic acid methyl ester IUPAC Name: methyl (E)-6-(2-methoxy-3,4-dimethyl-5-methylsulfanylphenyl)-4-methylhex-4-enoate Traditional Name: (E)-6-[2-methoxy-3,4-dimethyl-5-(methylthio)phenyl]-4-methyl-hex-4-enoic acid methyl ester Formula: C18H26O3S MolecularWeight: 322.46224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1C)OC)CC=C(C)CCC(=O)OC)SC

Isomeric SMILES

CC1=C(C=C(C(=C1C)OC)C/C=C(\C)/CCC(=O)OC)SC

InChI

InChI=1S/C18H26O3S/c1-12(8-10-17(19)20-4)7-9-15-11-16(22-6)13(2)14(3)18(15)21-5/h7,11H,8-10H2,1-6H3/b12-7+