(E)-3-[3,4-di(pentadecoxy)-4-propylsulfanyl-cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-[3,4-di(pentadecoxy)-4-propylsulfanyl-cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-[3,4-di(pentadecoxy)-4-propylsulfanyl-cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[3,4-di(pentadecoxy)-4-(propylthio)-1-cyclohexa-2,5-dienyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-[3,4-di(pentadecoxy)-4-propylsulfanylcyclohexa-2,5-dien-1-yl]-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[3,4-di(pentadecoxy)-4-(propylthio)cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one Formula: C48H80O3S MolecularWeight: 737.212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC1=CC(C=CC1(OCCCCCCCCCCCCCCC)SCCC)C=CC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCOC1=CC(C=CC1(OCCCCCCCCCCCCCCC)SCCC)/C=C/C(=O)C2=CC=CC=C2

InChI

InChI=1S/C48H80O3S/c1-4-7-9-11-13-15-17-19-21-23-25-27-32-40-50-47-43-44(36-37-46(49)45-34-30-29-31-35-45)38-39-48(47,52-42-6-3)51-41-33-28-26-24-22-20-18-16-14-12-10-8-5-2/h29-31,34-39,43-44H,4-28,32-33,40-42H2,1-3H3/b37-36+