1-(3-imidazol-1-ylpropylcarbamoyl)piperidine-3-carboxylic acid

Systemtic Name: 1-(3-imidazol-1-ylpropylcarbamoyl)piperidine-3-carboxylic acid Openeye Name: 1-(3-imidazol-1-ylpropylcarbamoyl)piperidine-3-carboxylic acid CAS Name: 1-[[3-(1-imidazolyl)propylamino]-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(3-imidazol-1-ylpropylcarbamoyl)piperidine-3-carboxylic acid Traditional Name: 1-(3-imidazol-1-ylpropylcarbamoyl)nipecotic acid Formula: C13H20N4O3 MolecularWeight: 280.3229

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)NCCCN2C=CN=C2)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)NCCCN2C=CN=C2)C(=O)O

InChI

InChI=1S/C13H20N4O3/c18-12(19)11-3-1-7-17(9-11)13(20)15-4-2-6-16-8-5-14-10-16/h5,8,10-11H,1-4,6-7,9H2,(H,15,20)(H,18,19)