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

Systemtic Name: (E)-3-(3,4-dioctoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3,4-dioctoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-3-(3,4-dioctoxyphenyl)-1-[4-(propylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3,4-dioctoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3,4-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=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)SCCC)OCCCCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C34H50O3S/c1-4-7-9-11-13-15-25-36-33-24-18-29(28-34(33)37-26-16-14-12-10-8-5-2)17-23-32(35)30-19-21-31(22-20-30)38-27-6-3/h17-24,28H,4-16,25-27H2,1-3H3/b23-17+