3-[(E)-3-(4-methylphenyl)prop-2-enoyl]-2-oxidanyl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 3-[(E)-3-(4-methylphenyl)prop-2-enoyl]-2-oxidanyl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-hydroxy-3-[(E)-3-(p-tolyl)prop-2-enoyl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-hydroxy-3-[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-hydroxy-3-[(E)-3-(4-methylphenyl)prop-2-enoyl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-hydroxy-3-[(E)-3-(p-tolyl)acryloyl]cyclohepta-2,4,6-trien-1-one Formula: C17H14O3 MolecularWeight: 266.29126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)C2=C(C(=O)C=CC=C2)O

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)C2=C(C(=O)C=CC=C2)O

InChI

InChI=1S/C17H14O3/c1-12-6-8-13(9-7-12)10-11-15(18)14-4-2-3-5-16(19)17(14)20/h2-11H,1H3,(H,19,20)/b11-10+