1-[[2-oxidanylidene-2-(propylamino)ethyl]carbamoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[2-oxidanylidene-2-(propylamino)ethyl]carbamoyl]piperidine-4-carboxylic acid Openeye Name: 1-[[2-oxo-2-(propylamino)ethyl]carbamoyl]piperidine-4-carboxylic acid CAS Name: 1-[oxo-[[2-oxo-2-(propylamino)ethyl]amino]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[2-oxo-2-(propylamino)ethyl]carbamoyl]piperidine-4-carboxylic acid Traditional Name: 1-[[2-keto-2-(propylamino)ethyl]carbamoyl]isonipecotic acid Formula: C12H21N3O4 MolecularWeight: 271.31284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)N1CCC(CC1)C(=O)O

Isomeric SMILES

CCCNC(=O)CNC(=O)N1CCC(CC1)C(=O)O

InChI

InChI=1S/C12H21N3O4/c1-2-5-13-10(16)8-14-12(19)15-6-3-9(4-7-15)11(17)18/h9H,2-8H2,1H3,(H,13,16)(H,14,19)(H,17,18)