ethyl (E)-6-cyclohexyl-2-phenylsulfanyl-hex-4-enoate

Systemtic Name: ethyl (E)-6-cyclohexyl-2-phenylsulfanyl-hex-4-enoate Openeye Name: ethyl (E)-6-cyclohexyl-2-phenylsulfanyl-hex-4-enoate CAS Name: (E)-6-cyclohexyl-2-(phenylthio)-4-hexenoic acid ethyl ester IUPAC Name: ethyl (E)-6-cyclohexyl-2-phenylsulfanylhex-4-enoate Traditional Name: (E)-6-cyclohexyl-2-(phenylthio)hex-4-enoic acid ethyl ester Formula: C20H28O2S MolecularWeight: 332.50012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=CCC1CCCCC1)SC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C/C=C/CC1CCCCC1)SC2=CC=CC=C2

InChI

InChI=1S/C20H28O2S/c1-2-22-20(21)19(23-18-14-7-4-8-15-18)16-10-9-13-17-11-5-3-6-12-17/h4,7-10,14-15,17,19H,2-3,5-6,11-13,16H2,1H3/b10-9+