(E)-1-phenyl-3-(2,3,5-triethoxy-4-nonadecylsulfanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-phenyl-3-(2,3,5-triethoxy-4-nonadecylsulfanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-phenyl-3-(2,3,5-triethoxy-4-nonadecylsulfanyl-phenyl)prop-2-en-1-one CAS Name: (E)-1-phenyl-3-[2,3,5-triethoxy-4-(nonadecylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-1-phenyl-3-(2,3,5-triethoxy-4-nonadecylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-1-phenyl-3-[2,3,5-triethoxy-4-(nonadecylthio)phenyl]prop-2-en-1-one Formula: C40H62O4S MolecularWeight: 638.98288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCSC1=C(C=C(C(=C1OCC)OCC)C=CC(=O)C2=CC=CC=C2)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCSC1=C(C=C(C(=C1OCC)OCC)/C=C/C(=O)C2=CC=CC=C2)OCC

InChI

InChI=1S/C40H62O4S/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-32-45-40-37(42-6-2)33-35(38(43-7-3)39(40)44-8-4)30-31-36(41)34-28-25-24-26-29-34/h24-26,28-31,33H,5-23,27,32H2,1-4H3/b31-30+