ethyl (E)-5,5-dimethyl-4-phenylsulfanyl-hex-2-enoate

Systemtic Name: ethyl (E)-5,5-dimethyl-4-phenylsulfanyl-hex-2-enoate Openeye Name: ethyl (E)-5,5-dimethyl-4-phenylsulfanyl-hex-2-enoate CAS Name: (E)-5,5-dimethyl-4-(phenylthio)-2-hexenoic acid ethyl ester IUPAC Name: ethyl (E)-5,5-dimethyl-4-phenylsulfanylhex-2-enoate Traditional Name: (E)-5,5-dimethyl-4-(phenylthio)hex-2-enoic acid ethyl ester Formula: C16H22O2S MolecularWeight: 278.40968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C=C/C(C(C)(C)C)SC1=CC=CC=C1

InChI

InChI=1S/C16H22O2S/c1-5-18-15(17)12-11-14(16(2,3)4)19-13-9-7-6-8-10-13/h6-12,14H,5H2,1-4H3/b12-11+