1,2,2-trimethyl-3-(phenylmethyl)cyclopentane-1-carboxylic acid

Systemtic Name: 1,2,2-trimethyl-3-(phenylmethyl)cyclopentane-1-carboxylic acid Openeye Name: 3-benzyl-1,2,2-trimethyl-cyclopentanecarboxylic acid CAS Name: 1,2,2-trimethyl-3-(phenylmethyl)-1-cyclopentanecarboxylic acid IUPAC Name: 3-benzyl-1,2,2-trimethylcyclopentane-1-carboxylic acid Traditional Name: 3-benzyl-1,2,2-trimethyl-cyclopentanecarboxylic acid Formula: C16H22O2 MolecularWeight: 246.34468

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)O)CC2=CC=CC=C2)C

Isomeric SMILES

CC1(C(CCC1(C)C(=O)O)CC2=CC=CC=C2)C

InChI

InChI=1S/C16H22O2/c1-15(2)13(9-10-16(15,3)14(17)18)11-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H,17,18)