5-(3-methyl-3-oxidanyl-butyl)-2-oxidanyl-6-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 5-(3-methyl-3-oxidanyl-butyl)-2-oxidanyl-6-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-hydroxy-5-(3-hydroxy-3-methyl-butyl)-6-isopropyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2-hydroxy-5-(3-hydroxy-3-methylbutyl)-6-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-hydroxy-5-(3-hydroxy-3-methylbutyl)-6-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 2-hydroxy-5-(3-hydroxy-3-methyl-butyl)-6-isopropyl-cyclohepta-2,4,6-trien-1-one Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)C(=CC=C1CCC(C)(C)O)O

Isomeric SMILES

CC(C)C1=CC(=O)C(=CC=C1CCC(C)(C)O)O

InChI

InChI=1S/C15H22O3/c1-10(2)12-9-14(17)13(16)6-5-11(12)7-8-15(3,4)18/h5-6,9-10,18H,7-8H2,1-4H3,(H,16,17)