aminocarbonyl-dimethyl-(4-oxidanyl-4-oxidanylidene-2-pyridin-3-ylcarbonyloxy-butyl)azanium

Systemtic Name: aminocarbonyl-dimethyl-(4-oxidanyl-4-oxidanylidene-2-pyridin-3-ylcarbonyloxy-butyl)azanium Openeye Name: carbamoyl-[4-hydroxy-4-oxo-2-(pyridine-3-carbonyloxy)butyl]-dimethyl-ammonium CAS Name: carbamoyl-[4-hydroxy-4-oxo-2-[oxo(3-pyridinyl)methoxy]butyl]-dimethylammonium IUPAC Name: carbamoyl-[4-hydroxy-4-oxo-2-(pyridine-3-carbonyloxy)butyl]-dimethylazanium Traditional Name: carbamoyl-(4-hydroxy-4-keto-2-nicotinoyloxy-butyl)-dimethyl-ammonium Formula: C13H18N3O5+ MolecularWeight: 296.29912

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC(CC(=O)O)OC(=O)C1=CN=CC=C1)C(=O)N

Isomeric SMILES

C[N+](C)(CC(CC(=O)O)OC(=O)C1=CN=CC=C1)C(=O)N

InChI

InChI=1S/C13H17N3O5/c1-16(2,13(14)20)8-10(6-11(17)18)21-12(19)9-4-3-5-15-7-9/h3-5,7,10H,6,8H2,1-2H3,(H2-,14,17,18,20)/p+1