4-(phenylmethyl)-1-(1H-pyrazol-4-ylcarbonyl)piperidine-4-carboxylic acid

Systemtic Name: 4-(phenylmethyl)-1-(1H-pyrazol-4-ylcarbonyl)piperidine-4-carboxylic acid Openeye Name: 4-benzyl-1-(1H-pyrazole-4-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[oxo(1H-pyrazol-4-yl)methyl]-4-(phenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 4-benzyl-1-(1H-pyrazole-4-carbonyl)piperidine-4-carboxylic acid Traditional Name: 4-benzyl-1-(1H-pyrazole-4-carbonyl)isonipecotic acid Formula: C17H19N3O3 MolecularWeight: 313.35106

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC2=CC=CC=C2)C(=O)O)C(=O)C3=CNN=C3

Isomeric SMILES

C1CN(CCC1(CC2=CC=CC=C2)C(=O)O)C(=O)C3=CNN=C3

InChI

InChI=1S/C17H19N3O3/c21-15(14-11-18-19-12-14)20-8-6-17(7-9-20,16(22)23)10-13-4-2-1-3-5-13/h1-5,11-12H,6-10H2,(H,18,19)(H,22,23)