(E)-3-cyclohexa-2,4-dien-1-yl-1-(2-methoxy-6-sulfanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-3-cyclohexa-2,4-dien-1-yl-1-(2-methoxy-6-sulfanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-3-cyclohexa-2,4-dien-1-yl-1-(2-methoxy-6-sulfanyl-phenyl)prop-2-en-1-one CAS Name: (E)-3-(1-cyclohexa-2,4-dienyl)-1-(2-mercapto-6-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-cyclohexa-2,4-dien-1-yl-1-(2-methoxy-6-sulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-cyclohexa-2,4-dien-1-yl-1-(2-mercapto-6-methoxy-phenyl)prop-2-en-1-one Formula: C16H16O2S MolecularWeight: 272.36204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)S)C(=O)C=CC2CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC=C1)S)C(=O)/C=C/C2CC=CC=C2

InChI

InChI=1S/C16H16O2S/c1-18-14-8-5-9-15(19)16(14)13(17)11-10-12-6-3-2-4-7-12/h2-6,8-12,19H,7H2,1H3/b11-10+