1-[(2-ethyl-6-methyl-phenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2-ethyl-6-methyl-phenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2-ethyl-6-methyl-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2-ethyl-6-methylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-ethyl-6-methylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(2-ethyl-6-methyl-benzyl)isonipecotic acid Formula: C16H23NO2 MolecularWeight: 261.35932

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1CN2CCC(CC2)C(=O)O)C

Isomeric SMILES

CCC1=CC=CC(=C1CN2CCC(CC2)C(=O)O)C

InChI

InChI=1S/C16H23NO2/c1-3-13-6-4-5-12(2)15(13)11-17-9-7-14(8-10-17)16(18)19/h4-6,14H,3,7-11H2,1-2H3,(H,18,19)