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

Systemtic Name: (E)-3-(4-henicosoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-henicosoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-3-(4-heneicosoxyphenyl)-1-[4-(propylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-henicosoxyphenyl)-1-(4-propylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-heneicosoxyphenyl)-1-[4-(propylthio)phenyl]prop-2-en-1-one Formula: C39H60O2S MolecularWeight: 592.9575

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)SCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)SCCC

InChI

InChI=1S/C39H60O2S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-33-41-37-28-23-35(24-29-37)25-32-39(40)36-26-30-38(31-27-36)42-34-4-2/h23-32H,3-22,33-34H2,1-2H3/b32-25+