(E)-3-(3-bromanyl-4-heptylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(3-bromanyl-4-heptylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(3-bromo-4-heptylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[3-bromo-4-(heptylthio)phenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(3-bromo-4-heptylsulfanylphenyl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[3-bromo-4-(heptylthio)phenyl]-1-phenyl-prop-2-en-1-one Formula: C22H25BrOS MolecularWeight: 417.4023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=C(C=C(C=C1)C=CC(=O)C2=CC=CC=C2)Br

Isomeric SMILES

CCCCCCCSC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=CC=C2)Br

InChI

InChI=1S/C22H25BrOS/c1-2-3-4-5-9-16-25-22-15-13-18(17-20(22)23)12-14-21(24)19-10-7-6-8-11-19/h6-8,10-15,17H,2-5,9,16H2,1H3/b14-12+