(E)-3-(3,5-diheptoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3,5-diheptoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3,5-diheptoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-3-(3,5-diheptoxyphenyl)-1-[4-(propylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3,5-diheptoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3,5-diheptoxyphenyl)-1-[4-(propylthio)phenyl]prop-2-en-1-one Formula: C32H46O3S MolecularWeight: 510.77084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC(=CC(=C1)C=CC(=O)C2=CC=C(C=C2)SCCC)OCCCCCCC

Isomeric SMILES

CCCCCCCOC1=CC(=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)SCCC)OCCCCCCC

InChI

InChI=1S/C32H46O3S/c1-4-7-9-11-13-21-34-29-24-27(25-30(26-29)35-22-14-12-10-8-5-2)15-20-32(33)28-16-18-31(19-17-28)36-23-6-3/h15-20,24-26H,4-14,21-23H2,1-3H3/b20-15+