3-[2-methyl-6-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)phenyl]cyclopentane-1-carboxylic acid

Systemtic Name: 3-[2-methyl-6-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)phenyl]cyclopentane-1-carboxylic acid Openeye Name: 3-[2-(2-hydroxy-1,1-dimethyl-2-oxo-ethyl)-6-methyl-phenyl]cyclopentanecarboxylic acid CAS Name: 3-[2-(1-hydroxy-2-methyl-1-oxopropan-2-yl)-6-methylphenyl]-1-cyclopentanecarboxylic acid IUPAC Name: 3-[2-(1-hydroxy-2-methyl-1-oxopropan-2-yl)-6-methylphenyl]cyclopentane-1-carboxylic acid Traditional Name: 3-[2-(2-hydroxy-2-keto-1,1-dimethyl-ethyl)-6-methyl-phenyl]cyclopentanecarboxylic acid Formula: C17H22O4 MolecularWeight: 290.35418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)(C)C(=O)O)C2CCC(C2)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)(C)C(=O)O)C2CCC(C2)C(=O)O

InChI

InChI=1S/C17H22O4/c1-10-5-4-6-13(17(2,3)16(20)21)14(10)11-7-8-12(9-11)15(18)19/h4-6,11-12H,7-9H2,1-3H3,(H,18,19)(H,20,21)