(E)-3-(5-chloranyl-5-octylsulfanyl-cyclohexa-1,3-dien-1-yl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(5-chloranyl-5-octylsulfanyl-cyclohexa-1,3-dien-1-yl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(5-chloro-5-octylsulfanyl-cyclohexa-1,3-dien-1-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[5-chloro-5-(octylthio)-1-cyclohexa-1,3-dienyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(5-chloro-5-octylsulfanylcyclohexa-1,3-dien-1-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[5-chloro-5-(octylthio)cyclohexa-1,3-dien-1-yl]-1-phenyl-prop-2-en-1-one Formula: C23H29ClOS MolecularWeight: 388.99376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1(CC(=CC=C1)C=CC(=O)C2=CC=CC=C2)Cl

Isomeric SMILES

CCCCCCCCSC1(CC(=CC=C1)/C=C/C(=O)C2=CC=CC=C2)Cl

InChI

InChI=1S/C23H29ClOS/c1-2-3-4-5-6-10-18-26-23(24)17-11-12-20(19-23)15-16-22(25)21-13-8-7-9-14-21/h7-9,11-17H,2-6,10,18-19H2,1H3/b16-15+