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

Systemtic Name: (E)-1-phenyl-3-(2,3,4-triethoxy-4-nonadecylsulfanyl-cyclohexa-2,5-dien-1-yl)prop-2-en-1-one Openeye Name: (E)-1-phenyl-3-(2,3,4-triethoxy-4-nonadecylsulfanyl-cyclohexa-2,5-dien-1-yl)prop-2-en-1-one CAS Name: (E)-1-phenyl-3-[2,3,4-triethoxy-4-(nonadecylthio)-1-cyclohexa-2,5-dienyl]-2-propen-1-one IUPAC Name: (E)-1-phenyl-3-(2,3,4-triethoxy-4-nonadecylsulfanylcyclohexa-2,5-dien-1-yl)prop-2-en-1-one Traditional Name: (E)-1-phenyl-3-[2,3,4-triethoxy-4-(nonadecylthio)cyclohexa-2,5-dien-1-yl]prop-2-en-1-one Formula: C40H64O4S MolecularWeight: 640.99876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C40H64O4S/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-34-45-40(44-8-4)33-32-36(38(42-6-2)39(40)43-7-3)30-31-37(41)35-28-25-24-26-29-35/h24-26,28-33,36H,5-23,27,34H2,1-4H3/b31-30+