1-[2-(2-methylpropylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: 1-[2-(2-methylpropylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: 1-[2-(isobutylamino)-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylate CAS Name: 1-[2-(2-methylpropylamino)-2-oxoethyl]-6-oxo-3-pyridinecarboxylate IUPAC Name: 1-[2-(2-methylpropylamino)-2-oxoethyl]-6-oxopyridine-3-carboxylate Traditional Name: 1-[2-(isobutylamino)-2-keto-ethyl]-6-keto-nicotinate Formula: C12H15N2O4- MolecularWeight: 251.2585

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CN1C=C(C=CC1=O)C(=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)CN1C=C(C=CC1=O)C(=O)[O-]

InChI

InChI=1S/C12H16N2O4/c1-8(2)5-13-10(15)7-14-6-9(12(17)18)3-4-11(14)16/h3-4,6,8H,5,7H2,1-2H3,(H,13,15)(H,17,18)/p-1