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

Systemtic Name: (E)-3-(3-heptadecoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3-heptadecoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-3-(3-heptadecoxyphenyl)-1-[4-(propylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3-heptadecoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3-heptadecoxyphenyl)-1-[4-(propylthio)phenyl]prop-2-en-1-one Formula: C35H52O2S MolecularWeight: 536.85118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)C=CC(=O)C2=CC=C(C=C2)SCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)SCCC

InChI

InChI=1S/C35H52O2S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-37-33-21-19-20-31(30-33)22-27-35(36)32-23-25-34(26-24-32)38-29-4-2/h19-27,30H,3-18,28-29H2,1-2H3/b27-22+