(3S)-1-[5-(2-azanylethanoylamino)pyridin-2-yl]piperidine-3-carboxylic acid

Systemtic Name: (3S)-1-[5-(2-azanylethanoylamino)pyridin-2-yl]piperidine-3-carboxylic acid Openeye Name: (3S)-1-[5-[(2-aminoacetyl)amino]-2-pyridyl]piperidine-3-carboxylic acid CAS Name: (3S)-1-[5-[(2-amino-1-oxoethyl)amino]-2-pyridinyl]-3-piperidinecarboxylic acid IUPAC Name: (3S)-1-[5-[(2-aminoacetyl)amino]pyridin-2-yl]piperidine-3-carboxylic acid Traditional Name: (3S)-1-[5-(glycylamino)-2-pyridyl]nipecotic acid Formula: C13H18N4O3 MolecularWeight: 278.30702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=C(C=C2)NC(=O)CN)C(=O)O

InChI

InChI=1S/C13H18N4O3/c14-6-12(18)16-10-3-4-11(15-7-10)17-5-1-2-9(8-17)13(19)20/h3-4,7,9H,1-2,5-6,8,14H2,(H,16,18)(H,19,20)/t9-/m0/s1