(E)-1-(4-propylsulfanylphenyl)-3-(3,4,5-triheptoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-propylsulfanylphenyl)-3-(3,4,5-triheptoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-propylsulfanylphenyl)-3-(3,4,5-triheptoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(propylthio)phenyl]-3-(3,4,5-triheptoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-propylsulfanylphenyl)-3-(3,4,5-triheptoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(propylthio)phenyl]-3-(3,4,5-triheptoxyphenyl)prop-2-en-1-one Formula: C39H60O4S MolecularWeight: 624.9563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC(=CC(=C1OCCCCCCC)OCCCCCCC)C=CC(=O)C2=CC=C(C=C2)SCCC

Isomeric SMILES

CCCCCCCOC1=CC(=CC(=C1OCCCCCCC)OCCCCCCC)/C=C/C(=O)C2=CC=C(C=C2)SCCC

InChI

InChI=1S/C39H60O4S/c1-5-9-12-15-18-27-41-37-31-33(21-26-36(40)34-22-24-35(25-23-34)44-30-8-4)32-38(42-28-19-16-13-10-6-2)39(37)43-29-20-17-14-11-7-3/h21-26,31-32H,5-20,27-30H2,1-4H3/b26-21+