3-azanyl-4-oxidanylidene-4-(pyridin-2-ylmethylamino)butanoate

Systemtic Name: 3-azanyl-4-oxidanylidene-4-(pyridin-2-ylmethylamino)butanoate Openeye Name: 3-amino-4-oxo-4-(2-pyridylmethylamino)butanoate CAS Name: 3-amino-4-oxo-4-(2-pyridinylmethylamino)butanoate IUPAC Name: 3-amino-4-oxo-4-(pyridin-2-ylmethylamino)butanoate Traditional Name: 3-amino-4-keto-4-(2-pyridylmethylamino)butyrate Formula: C10H12N3O3- MolecularWeight: 222.22058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC(=O)C(CC(=O)[O-])N

Isomeric SMILES

C1=CC=NC(=C1)CNC(=O)C(CC(=O)[O-])N

InChI

InChI=1S/C10H13N3O3/c11-8(5-9(14)15)10(16)13-6-7-3-1-2-4-12-7/h1-4,8H,5-6,11H2,(H,13,16)(H,14,15)/p-1