1-(pentan-3-ylcarbamoyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(pentan-3-ylcarbamoyl)piperidine-4-carboxylic acid Openeye Name: 1-(1-ethylpropylcarbamoyl)piperidine-4-carboxylic acid CAS Name: 1-[oxo-(pentan-3-ylamino)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(pentan-3-ylcarbamoyl)piperidine-4-carboxylic acid Traditional Name: 1-(1-ethylpropylcarbamoyl)isonipecotic acid Formula: C12H22N2O3 MolecularWeight: 242.31468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)N1CCC(CC1)C(=O)O

Isomeric SMILES

CCC(CC)NC(=O)N1CCC(CC1)C(=O)O

InChI

InChI=1S/C12H22N2O3/c1-3-10(4-2)13-12(17)14-7-5-9(6-8-14)11(15)16/h9-10H,3-8H2,1-2H3,(H,13,17)(H,15,16)