5-cyclohexyl-3-(2-methylheptan-2-yl)-2-oxidanyl-benzoic acid

Systemtic Name: 5-cyclohexyl-3-(2-methylheptan-2-yl)-2-oxidanyl-benzoic acid Openeye Name: 5-cyclohexyl-3-(1,1-dimethylhexyl)-2-hydroxy-benzoic acid CAS Name: 5-cyclohexyl-2-hydroxy-3-(2-methylheptan-2-yl)benzoic acid IUPAC Name: 5-cyclohexyl-2-hydroxy-3-(2-methylheptan-2-yl)benzoic acid Traditional Name: 5-cyclohexyl-3-(1,1-dimethylhexyl)-2-hydroxy-benzoic acid Formula: C21H32O3 MolecularWeight: 332.47698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=C(C(=CC(=C1)C2CCCCC2)C(=O)O)O

Isomeric SMILES

CCCCCC(C)(C)C1=C(C(=CC(=C1)C2CCCCC2)C(=O)O)O

InChI

InChI=1S/C21H32O3/c1-4-5-9-12-21(2,3)18-14-16(15-10-7-6-8-11-15)13-17(19(18)22)20(23)24/h13-15,22H,4-12H2,1-3H3,(H,23,24)