(E)-3-(4-dodecylsulfanyl-2,6-dimethyl-phenyl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(4-dodecylsulfanyl-2,6-dimethyl-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(4-dodecylsulfanyl-2,6-dimethyl-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[4-(dodecylthio)-2,6-dimethylphenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(4-dodecylsulfanyl-2,6-dimethylphenyl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[4-(laurylthio)-2,6-dimethyl-phenyl]-1-phenyl-prop-2-en-1-one Formula: C29H40OS MolecularWeight: 436.6923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1=CC(=C(C(=C1)C)C=CC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CCCCCCCCCCCCSC1=CC(=C(C(=C1)C)/C=C/C(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C29H40OS/c1-4-5-6-7-8-9-10-11-12-16-21-31-27-22-24(2)28(25(3)23-27)19-20-29(30)26-17-14-13-15-18-26/h13-15,17-20,22-23H,4-12,16,21H2,1-3H3/b20-19+