ethyl (E)-4-methyl-2-methylsulfanyl-7-phenyl-hept-4-enoate

Systemtic Name: ethyl (E)-4-methyl-2-methylsulfanyl-7-phenyl-hept-4-enoate Openeye Name: ethyl (E)-4-methyl-2-methylsulfanyl-7-phenyl-hept-4-enoate CAS Name: (E)-4-methyl-2-(methylthio)-7-phenyl-4-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-4-methyl-2-methylsulfanyl-7-phenylhept-4-enoate Traditional Name: (E)-4-methyl-2-(methylthio)-7-phenyl-hept-4-enoic acid ethyl ester Formula: C17H24O2S MolecularWeight: 292.43626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=CCCC1=CC=CC=C1)C)SC

Isomeric SMILES

CCOC(=O)C(C/C(=C/CCC1=CC=CC=C1)/C)SC

InChI

InChI=1S/C17H24O2S/c1-4-19-17(18)16(20-3)13-14(2)9-8-12-15-10-6-5-7-11-15/h5-7,9-11,16H,4,8,12-13H2,1-3H3/b14-9+