(E)-3-(4-methylsulfanyl-4-octyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(4-methylsulfanyl-4-octyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(4-methylsulfanyl-4-octyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[4-(methylthio)-4-octyl-1-cyclohexa-2,5-dienyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(4-methylsulfanyl-4-octylcyclohexa-2,5-dien-1-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[4-(methylthio)-4-octyl-cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one Formula: C24H32OS MolecularWeight: 368.57528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(C=CC(C=C1)C=CC(=O)C2=CC=CC=C2)SC

Isomeric SMILES

CCCCCCCCC1(C=CC(C=C1)/C=C/C(=O)C2=CC=CC=C2)SC

InChI

InChI=1S/C24H32OS/c1-3-4-5-6-7-11-18-24(26-2)19-16-21(17-20-24)14-15-23(25)22-12-9-8-10-13-22/h8-10,12-17,19-21H,3-7,11,18H2,1-2H3/b15-14+