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

Systemtic Name: (E)-3-(3-hexadecoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3-hexadecoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-3-(3-hexadecoxyphenyl)-1-[4-(propylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3-hexadecoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3-cetyloxyphenyl)-1-[4-(propylthio)phenyl]prop-2-en-1-one Formula: C34H50O2S MolecularWeight: 522.8246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=CC(=C1)C=CC(=O)C2=CC=C(C=C2)SCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)SCCC

InChI

InChI=1S/C34H50O2S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-27-36-32-20-18-19-30(29-32)21-26-34(35)31-22-24-33(25-23-31)37-28-4-2/h18-26,29H,3-17,27-28H2,1-2H3/b26-21+