4-[methyl-(1-methyl-2-oxidanylidene-pyridin-4-yl)carbonyl-amino]butanoic acid

Systemtic Name: 4-[methyl-(1-methyl-2-oxidanylidene-pyridin-4-yl)carbonyl-amino]butanoic acid Openeye Name: 4-[methyl-(1-methyl-2-oxo-pyridine-4-carbonyl)amino]butanoic acid CAS Name: 4-[methyl-[(1-methyl-2-oxo-4-pyridinyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[methyl-(1-methyl-2-oxopyridine-4-carbonyl)amino]butanoic acid Traditional Name: 4-[(2-keto-1-methyl-isonicotinoyl)-methyl-amino]butyric acid Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=CC1=O)C(=O)N(C)CCCC(=O)O

Isomeric SMILES

CN1C=CC(=CC1=O)C(=O)N(C)CCCC(=O)O

InChI

InChI=1S/C12H16N2O4/c1-13-7-5-9(8-10(13)15)12(18)14(2)6-3-4-11(16)17/h5,7-8H,3-4,6H2,1-2H3,(H,16,17)