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

Systemtic Name: (E)-3-[3,5-di(pentadecoxy)-4-propylsulfanyl-phenyl]-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-[3,5-di(pentadecoxy)-4-propylsulfanyl-phenyl]-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[3,5-di(pentadecoxy)-4-(propylthio)phenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-[3,5-di(pentadecoxy)-4-propylsulfanylphenyl]-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[3,5-di(pentadecoxy)-4-(propylthio)phenyl]-1-phenyl-prop-2-en-1-one Formula: C48H78O3S MolecularWeight: 735.19612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC1=CC(=CC(=C1SCCC)OCCCCCCCCCCCCCCC)C=CC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCOC1=CC(=CC(=C1SCCC)OCCCCCCCCCCCCCCC)/C=C/C(=O)C2=CC=CC=C2

InChI

InChI=1S/C48H78O3S/c1-4-7-9-11-13-15-17-19-21-23-25-27-32-38-50-46-41-43(36-37-45(49)44-34-30-29-31-35-44)42-47(48(46)52-40-6-3)51-39-33-28-26-24-22-20-18-16-14-12-10-8-5-2/h29-31,34-37,41-42H,4-28,32-33,38-40H2,1-3H3/b37-36+