4-(furan-2-ylmethylamino)-4-oxidanylidene-2-(pyridin-3-ylmethylamino)butanoic acid

Systemtic Name: 4-(furan-2-ylmethylamino)-4-oxidanylidene-2-(pyridin-3-ylmethylamino)butanoic acid Openeye Name: 4-(2-furylmethylamino)-4-oxo-2-(3-pyridylmethylamino)butanoic acid CAS Name: 4-(2-furanylmethylamino)-4-oxo-2-(3-pyridinylmethylamino)butanoic acid IUPAC Name: 4-(furan-2-ylmethylamino)-4-oxo-2-(pyridin-3-ylmethylamino)butanoic acid Traditional Name: 4-(2-furfurylamino)-4-keto-2-(3-pyridylmethylamino)butyric acid Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(CC(=O)NCC2=CC=CO2)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CNC(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)