5-(2-methylpropyl)-2-(6-piperidin-1-ylpyridazin-3-yl)pyrazole-3-carboxylic acid

Systemtic Name: 5-(2-methylpropyl)-2-(6-piperidin-1-ylpyridazin-3-yl)pyrazole-3-carboxylic acid Openeye Name: 5-isobutyl-2-[6-(1-piperidyl)pyridazin-3-yl]pyrazole-3-carboxylic acid CAS Name: 5-(2-methylpropyl)-2-[6-(1-piperidinyl)-3-pyridazinyl]-3-pyrazolecarboxylic acid IUPAC Name: 5-(2-methylpropyl)-2-(6-piperidin-1-ylpyridazin-3-yl)pyrazole-3-carboxylic acid Traditional Name: 5-isobutyl-2-(6-piperidinopyridazin-3-yl)pyrazole-3-carboxylic acid Formula: C17H23N5O2 MolecularWeight: 329.39682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN(C(=C1)C(=O)O)C2=NN=C(C=C2)N3CCCCC3

Isomeric SMILES

CC(C)CC1=NN(C(=C1)C(=O)O)C2=NN=C(C=C2)N3CCCCC3

InChI

InChI=1S/C17H23N5O2/c1-12(2)10-13-11-14(17(23)24)22(20-13)16-7-6-15(18-19-16)21-8-4-3-5-9-21/h6-7,11-12H,3-5,8-10H2,1-2H3,(H,23,24)