1-(phenylmethyl)cyclooctane-1-carboxylic acid

Systemtic Name: 1-(phenylmethyl)cyclooctane-1-carboxylic acid Openeye Name: 1-benzylcyclooctanecarboxylic acid CAS Name: 1-(phenylmethyl)-1-cyclooctanecarboxylic acid IUPAC Name: 1-benzylcyclooctane-1-carboxylic acid Traditional Name: 1-benzylcyclooctanecarboxylic acid Formula: C16H22O2 MolecularWeight: 246.34468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CCCC(CCC1)(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H22O2/c17-15(18)16(11-7-2-1-3-8-12-16)13-14-9-5-4-6-10-14/h4-6,9-10H,1-3,7-8,11-13H2,(H,17,18)