1-[3-(4-piperidin-4-ylpiperidin-1-yl)carbonylphenyl]carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[3-(4-piperidin-4-ylpiperidin-1-yl)carbonylphenyl]carbonylpiperidine-4-carboxylic acid Openeye Name: 1-[3-[4-(4-piperidyl)piperidine-1-carbonyl]benzoyl]piperidine-4-carboxylic acid CAS Name: 1-[oxo-[3-[oxo-[4-(4-piperidinyl)-1-piperidinyl]methyl]phenyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-(4-piperidin-4-ylpiperidine-1-carbonyl)benzoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-[4-(4-piperidyl)piperidine-1-carbonyl]benzoyl]isonipecotic acid Formula: C24H33N3O4 MolecularWeight: 427.53652

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2CCN(CC2)C(=O)C3=CC=CC(=C3)C(=O)N4CCC(CC4)C(=O)O

Isomeric SMILES

C1CNCCC1C2CCN(CC2)C(=O)C3=CC=CC(=C3)C(=O)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C24H33N3O4/c28-22(26-12-6-18(7-13-26)17-4-10-25-11-5-17)20-2-1-3-21(16-20)23(29)27-14-8-19(9-15-27)24(30)31/h1-3,16-19,25H,4-15H2,(H,30,31)