3-(2-hydroxyethyl)-2-oxidanyl-6-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 3-(2-hydroxyethyl)-2-oxidanyl-6-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-hydroxy-3-(2-hydroxyethyl)-6-isopropyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2-hydroxy-3-(2-hydroxyethyl)-6-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-hydroxy-3-(2-hydroxyethyl)-6-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 2-hydroxy-3-(2-hydroxyethyl)-6-isopropyl-cyclohepta-2,4,6-trien-1-one Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)C(=C(C=C1)CCO)O

Isomeric SMILES

CC(C)C1=CC(=O)C(=C(C=C1)CCO)O

InChI

InChI=1S/C12H16O3/c1-8(2)10-4-3-9(5-6-13)12(15)11(14)7-10/h3-4,7-8,13H,5-6H2,1-2H3,(H,14,15)