1-[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-oxo-2-[(1,3,5-trimethyl-4-pyrazolyl)amino]ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-keto-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]nipecotic acid Formula: C14H22N4O3 MolecularWeight: 294.34948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CN2CCCC(C2)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CN2CCCC(C2)C(=O)O

InChI

InChI=1S/C14H22N4O3/c1-9-13(10(2)17(3)16-9)15-12(19)8-18-6-4-5-11(7-18)14(20)21/h11H,4-8H2,1-3H3,(H,15,19)(H,20,21)