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

Systemtic Name: (E)-3-(3,4-dimethoxy-4-methylsulfanyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(3,4-dimethoxy-4-methylsulfanyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[3,4-dimethoxy-4-(methylthio)-1-cyclohexa-2,5-dienyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(3,4-dimethoxy-4-methylsulfanylcyclohexa-2,5-dien-1-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[3,4-dimethoxy-4-(methylthio)cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one Formula: C18H20O3S MolecularWeight: 316.4146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(C=CC1(OC)SC)C=CC(=O)C2=CC=CC=C2

Isomeric SMILES

COC1=CC(C=CC1(OC)SC)/C=C/C(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H20O3S/c1-20-17-13-14(11-12-18(17,21-2)22-3)9-10-16(19)15-7-5-4-6-8-15/h4-14H,1-3H3/b10-9+