1-(1-methyl-6-oxidanylidene-pyridazin-3-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(1-methyl-6-oxidanylidene-pyridazin-3-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(1-methyl-6-oxo-pyridazine-3-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(1-methyl-6-oxo-3-pyridazinyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(1-methyl-6-oxopyridazine-3-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(6-keto-1-methyl-pyridazine-3-carbonyl)isonipecotic acid Formula: C12H15N3O4 MolecularWeight: 265.2652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)C(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CN1C(=O)C=CC(=N1)C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C12H15N3O4/c1-14-10(16)3-2-9(13-14)11(17)15-6-4-8(5-7-15)12(18)19/h2-3,8H,4-7H2,1H3,(H,18,19)