(E)-3-(4-dodecylsulfanyl-2,4,6-trimethyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(4-dodecylsulfanyl-2,4,6-trimethyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(4-dodecylsulfanyl-2,4,6-trimethyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[4-(dodecylthio)-2,4,6-trimethyl-1-cyclohexa-2,5-dienyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(4-dodecylsulfanyl-2,4,6-trimethylcyclohexa-2,5-dien-1-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[4-(laurylthio)-2,4,6-trimethyl-cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one Formula: C30H44OS MolecularWeight: 452.73476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1(C=C(C(C(=C1)C)C=CC(=O)C2=CC=CC=C2)C)C

Isomeric SMILES

CCCCCCCCCCCCSC1(C=C(C(C(=C1)C)/C=C/C(=O)C2=CC=CC=C2)C)C

InChI

InChI=1S/C30H44OS/c1-5-6-7-8-9-10-11-12-13-17-22-32-30(4)23-25(2)28(26(3)24-30)20-21-29(31)27-18-15-14-16-19-27/h14-16,18-21,23-24,28H,5-13,17,22H2,1-4H3/b21-20+