(2R)-4-(furan-2-ylmethylamino)-4-oxidanylidene-2-(pyridin-3-ylmethylazaniumyl)butanoate

Systemtic Name: (2R)-4-(furan-2-ylmethylamino)-4-oxidanylidene-2-(pyridin-3-ylmethylazaniumyl)butanoate Openeye Name: (2R)-4-(2-furylmethylamino)-4-oxo-2-(3-pyridylmethylammonio)butanoate CAS Name: (2R)-4-(2-furanylmethylamino)-4-oxo-2-(3-pyridinylmethylammonio)butanoate IUPAC Name: (2R)-4-(furan-2-ylmethylamino)-4-oxo-2-(pyridin-3-ylmethylazaniumyl)butanoate Traditional Name: (2R)-4-(2-furfurylamino)-4-keto-2-(3-pyridylmethylammonio)butyrate Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C[NH2+]C(CC(=O)NCC2=CC=CO2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)C[NH2+][C@H](CC(=O)NCC2=CC=CO2)C(=O)[O-]

InChI

InChI=1S/C15H17N3O4/c19-14(18-10-12-4-2-6-22-12)7-13(15(20)21)17-9-11-3-1-5-16-8-11/h1-6,8,13,17H,7,9-10H2,(H,18,19)(H,20,21)/t13-/m1/s1