3-ethanoyl-2-oxidanyl-5-pentan-3-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 3-ethanoyl-2-oxidanyl-5-pentan-3-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 3-acetyl-5-(1-ethylpropyl)-2-hydroxy-cyclohepta-2,4,6-trien-1-one CAS Name: 3-acetyl-2-hydroxy-5-pentan-3-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 3-acetyl-2-hydroxy-5-pentan-3-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 3-acetyl-5-(1-ethylpropyl)-2-hydroxy-cyclohepta-2,4,6-trien-1-one Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC(=C(C(=O)C=C1)O)C(=O)C

Isomeric SMILES

CCC(CC)C1=CC(=C(C(=O)C=C1)O)C(=O)C

InChI

InChI=1S/C14H18O3/c1-4-10(5-2)11-6-7-13(16)14(17)12(8-11)9(3)15/h6-8,10H,4-5H2,1-3H3,(H,16,17)