1-hexyl-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-hexyl-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-hexyl-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-hexyl-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-hexyl-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-hexyl-4-phenyl-isonipecotic acid Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCC(CC1)(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCCCN1CCC(CC1)(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H27NO2/c1-2-3-4-8-13-19-14-11-18(12-15-19,17(20)21)16-9-6-5-7-10-16/h5-7,9-10H,2-4,8,11-15H2,1H3,(H,20,21)