1-[2-(4-methylphenyl)pyrazolo[4,3-d]pyrimidin-7-yl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(4-methylphenyl)pyrazolo[4,3-d]pyrimidin-7-yl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(p-tolyl)pyrazolo[4,3-d]pyrimidin-7-yl]piperidine-4-carboxylic acid CAS Name: 1-[2-(4-methylphenyl)-7-pyrazolo[4,3-d]pyrimidinyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(4-methylphenyl)pyrazolo[4,3-d]pyrimidin-7-yl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(p-tolyl)pyrazolo[4,3-d]pyrimidin-7-yl]isonipecotic acid Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C3C(=N2)C(=NC=N3)N4CCC(CC4)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C3C(=N2)C(=NC=N3)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C18H19N5O2/c1-12-2-4-14(5-3-12)23-10-15-16(21-23)17(20-11-19-15)22-8-6-13(7-9-22)18(24)25/h2-5,10-11,13H,6-9H2,1H3,(H,24,25)