1-[6-(4-methylphenyl)pyridazin-3-yl]piperidine-4-carboxylic acid

Systemtic Name: 1-[6-(4-methylphenyl)pyridazin-3-yl]piperidine-4-carboxylic acid Openeye Name: 1-[6-(p-tolyl)pyridazin-3-yl]piperidine-4-carboxylic acid CAS Name: 1-[6-(4-methylphenyl)-3-pyridazinyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[6-(4-methylphenyl)pyridazin-3-yl]piperidine-4-carboxylic acid Traditional Name: 1-[6-(p-tolyl)pyridazin-3-yl]isonipecotic acid Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C17H19N3O2/c1-12-2-4-13(5-3-12)15-6-7-16(19-18-15)20-10-8-14(9-11-20)17(21)22/h2-7,14H,8-11H2,1H3,(H,21,22)