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

Systemtic Name: (E)-3-(4-icosoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-icosoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-3-(4-eicosoxyphenyl)-1-[4-(propylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-icosoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-arachyloxyphenyl)-1-[4-(propylthio)phenyl]prop-2-en-1-one Formula: C38H58O2S MolecularWeight: 578.93092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)SCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)SCCC

InChI

InChI=1S/C38H58O2S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32-40-36-27-22-34(23-28-36)24-31-38(39)35-25-29-37(30-26-35)41-33-4-2/h22-31H,3-21,32-33H2,1-2H3/b31-24+