1-[2-(4-piperidin-4-ylpiperidin-4-yl)carbonylphenyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(4-piperidin-4-ylpiperidin-4-yl)carbonylphenyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[4-(4-piperidyl)piperidine-4-carbonyl]phenyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[oxo-[4-(4-piperidinyl)-4-piperidinyl]methyl]phenyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(4-piperidin-4-ylpiperidine-4-carbonyl)phenyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[4-(4-piperidyl)isonipecotoyl]phenyl]isonipecotic acid Formula: C23H33N3O3 MolecularWeight: 399.52642

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2(CCNCC2)C(=O)C3=CC=CC=C3N4CCC(CC4)C(=O)O

Isomeric SMILES

C1CNCCC1C2(CCNCC2)C(=O)C3=CC=CC=C3N4CCC(CC4)C(=O)O

InChI

InChI=1S/C23H33N3O3/c27-21(23(9-13-25-14-10-23)18-5-11-24-12-6-18)19-3-1-2-4-20(19)26-15-7-17(8-16-26)22(28)29/h1-4,17-18,24-25H,5-16H2,(H,28,29)