4-azanyl-2-[[6-(dimethylamino)pyridin-3-yl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[[6-(dimethylamino)pyridin-3-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[6-(dimethylamino)pyridine-3-carbonyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[[6-(dimethylamino)-3-pyridinyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[6-(dimethylamino)pyridine-3-carbonyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[6-(dimethylamino)nicotinoyl]amino]-4-keto-butyric acid Formula: C12H16N4O4 MolecularWeight: 280.27984

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=C1)C(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

CN(C)C1=NC=C(C=C1)C(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C12H16N4O4/c1-16(2)10-4-3-7(6-14-10)11(18)15-8(12(19)20)5-9(13)17/h3-4,6,8H,5H2,1-2H3,(H2,13,17)(H,15,18)(H,19,20)