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

Systemtic Name: (E)-3-(2,3,4,5,6-pentamethoxy-4-octadecylsulfanyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(2,3,4,5,6-pentamethoxy-4-octadecylsulfanyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[2,3,4,5,6-pentamethoxy-4-(octadecylthio)-1-cyclohexa-2,5-dienyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(2,3,4,5,6-pentamethoxy-4-octadecylsulfanylcyclohexa-2,5-dien-1-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[2,3,4,5,6-pentamethoxy-4-(stearylthio)cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one Formula: C38H60O6S MolecularWeight: 644.9444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1(C(=C(C(C(=C1OC)OC)C=CC(=O)C2=CC=CC=C2)OC)OC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1(C(=C(C(C(=C1OC)OC)/C=C/C(=O)C2=CC=CC=C2)OC)OC)OC

InChI

InChI=1S/C38H60O6S/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-30-45-38(44-6)36(42-4)34(40-2)32(35(41-3)37(38)43-5)28-29-33(39)31-26-23-22-24-27-31/h22-24,26-29,32H,7-21,25,30H2,1-6H3/b29-28+