3-methoxy-2-pyridin-3-ylcarbonyl-4-(trimethylazaniumyl)butanoate

Systemtic Name: 3-methoxy-2-pyridin-3-ylcarbonyl-4-(trimethylazaniumyl)butanoate Openeye Name: 3-methoxy-2-(pyridine-3-carbonyl)-4-(trimethylammonio)butanoate CAS Name: 3-methoxy-2-[oxo(3-pyridinyl)methyl]-4-(trimethylammonio)butanoate IUPAC Name: 3-methoxy-2-(pyridine-3-carbonyl)-4-(trimethylazaniumyl)butanoate Traditional Name: 3-methoxy-2-nicotinoyl-4-(trimethylammonio)butyrate Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O4/c1-16(2,3)9-11(20-4)12(14(18)19)13(17)10-6-5-7-15-8-10/h5-8,11-12H,9H2,1-4H3