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

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

Isomeric SMILES

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

InChI

InChI=1S/C39H60O2S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-32-41-37-25-23-24-35(34-37)26-31-39(40)36-27-29-38(30-28-36)42-33-4-2/h23-31,34H,3-22,32-33H2,1-2H3/b31-26+