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

Systemtic Name: (E)-3-(3,5-dioctoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3,5-dioctoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-3-(3,5-dioctoxyphenyl)-1-[4-(propylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3,5-dioctoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3,5-dioctoxyphenyl)-1-[4-(propylthio)phenyl]prop-2-en-1-one Formula: C34H50O3S MolecularWeight: 538.824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=CC(=C1)C=CC(=O)C2=CC=C(C=C2)SCCC)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC(=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)SCCC)OCCCCCCCC

InChI

InChI=1S/C34H50O3S/c1-4-7-9-11-13-15-23-36-31-26-29(27-32(28-31)37-24-16-14-12-10-8-5-2)17-22-34(35)30-18-20-33(21-19-30)38-25-6-3/h17-22,26-28H,4-16,23-25H2,1-3H3/b22-17+