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

Systemtic Name: 1-(6-oxidanylidene-1-propyl-pyridazin-3-yl)carbonylpiperidine-3-carboxylic acid Openeye Name: 1-(6-oxo-1-propyl-pyridazine-3-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[oxo-(6-oxo-1-propyl-3-pyridazinyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(6-oxo-1-propylpyridazine-3-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(6-keto-1-propyl-pyridazine-3-carbonyl)nipecotic acid Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C14H19N3O4/c1-2-7-17-12(18)6-5-11(15-17)13(19)16-8-3-4-10(9-16)14(20)21/h5-6,10H,2-4,7-9H2,1H3,(H,20,21)