2-tert-butyl-4-[[(phenylmethyl)amino]methyl]piperidine-1-carboxylic acid

Systemtic Name: 2-tert-butyl-4-[[(phenylmethyl)amino]methyl]piperidine-1-carboxylic acid Openeye Name: 4-[(benzylamino)methyl]-2-tert-butyl-piperidine-1-carboxylic acid CAS Name: 2-tert-butyl-4-[[(phenylmethyl)amino]methyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[(benzylamino)methyl]-2-tert-butylpiperidine-1-carboxylic acid Traditional Name: 4-[(benzylamino)methyl]-2-tert-butyl-piperidine-1-carboxylic acid Formula: C18H28N2O2 MolecularWeight: 304.42712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(CCN1C(=O)O)CNCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1CC(CCN1C(=O)O)CNCC2=CC=CC=C2

InChI

InChI=1S/C18H28N2O2/c1-18(2,3)16-11-15(9-10-20(16)17(21)22)13-19-12-14-7-5-4-6-8-14/h4-8,15-16,19H,9-13H2,1-3H3,(H,21,22)