(E)-3-(4-butylsulfanyl-4-chloranyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(4-butylsulfanyl-4-chloranyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(4-butylsulfanyl-4-chloro-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[4-(butylthio)-4-chloro-1-cyclohexa-2,5-dienyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(4-butylsulfanyl-4-chlorocyclohexa-2,5-dien-1-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[4-(butylthio)-4-chloro-cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one Formula: C19H21ClOS MolecularWeight: 332.88744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1(C=CC(C=C1)C=CC(=O)C2=CC=CC=C2)Cl

Isomeric SMILES

CCCCSC1(C=CC(C=C1)/C=C/C(=O)C2=CC=CC=C2)Cl

InChI

InChI=1S/C19H21ClOS/c1-2-3-15-22-19(20)13-11-16(12-14-19)9-10-18(21)17-7-5-4-6-8-17/h4-14,16H,2-3,15H2,1H3/b10-9+