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

Systemtic Name: (E)-1-phenyl-3-(3,4,5-triethyl-4-tridecylsulfanyl-cyclohexa-2,5-dien-1-yl)prop-2-en-1-one Openeye Name: (E)-1-phenyl-3-(3,4,5-triethyl-4-tridecylsulfanyl-cyclohexa-2,5-dien-1-yl)prop-2-en-1-one CAS Name: (E)-1-phenyl-3-[3,4,5-triethyl-4-(tridecylthio)-1-cyclohexa-2,5-dienyl]-2-propen-1-one IUPAC Name: (E)-1-phenyl-3-(3,4,5-triethyl-4-tridecylsulfanylcyclohexa-2,5-dien-1-yl)prop-2-en-1-one Traditional Name: (E)-1-phenyl-3-[3,4,5-triethyl-4-(tridecylthio)cyclohexa-2,5-dien-1-yl]prop-2-en-1-one Formula: C34H52OS MolecularWeight: 508.84108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCSC1(C(=CC(C=C1CC)C=CC(=O)C2=CC=CC=C2)CC)CC

Isomeric SMILES

CCCCCCCCCCCCCSC1(C(=CC(C=C1CC)/C=C/C(=O)C2=CC=CC=C2)CC)CC

InChI

InChI=1S/C34H52OS/c1-5-9-10-11-12-13-14-15-16-17-21-26-36-34(8-4)31(6-2)27-29(28-32(34)7-3)24-25-33(35)30-22-19-18-20-23-30/h18-20,22-25,27-29H,5-17,21,26H2,1-4H3/b25-24+