1-[3-(1-phenylmethoxycarbonylpiperidin-4-yl)propanoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[3-(1-phenylmethoxycarbonylpiperidin-4-yl)propanoyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-(1-benzyloxycarbonyl-4-piperidyl)propanoyl]piperidine-3-carboxylic acid CAS Name: 1-[1-oxo-3-(1-phenylmethoxycarbonyl-4-piperidinyl)propyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[3-(1-phenylmethoxycarbonylpiperidin-4-yl)propanoyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-(1-carbobenzoxy-4-piperidyl)propanoyl]nipecotic acid Formula: C22H30N2O5 MolecularWeight: 402.484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCC2CCN(CC2)C(=O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)CCC2CCN(CC2)C(=O)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H30N2O5/c25-20(24-12-4-7-19(15-24)21(26)27)9-8-17-10-13-23(14-11-17)22(28)29-16-18-5-2-1-3-6-18/h1-3,5-6,17,19H,4,7-16H2,(H,26,27)