5-[(1-methylpiperidin-2-yl)methoxy]-1-(4-propan-2-ylphenyl)pyrazole-4-carboxylic acid

Systemtic Name: 5-[(1-methylpiperidin-2-yl)methoxy]-1-(4-propan-2-ylphenyl)pyrazole-4-carboxylic acid Openeye Name: 1-(4-isopropylphenyl)-5-[(1-methyl-2-piperidyl)methoxy]pyrazole-4-carboxylic acid CAS Name: 5-[(1-methyl-2-piperidinyl)methoxy]-1-(4-propan-2-ylphenyl)-4-pyrazolecarboxylic acid IUPAC Name: 5-[(1-methylpiperidin-2-yl)methoxy]-1-(4-propan-2-ylphenyl)pyrazole-4-carboxylic acid Traditional Name: 5-[(1-methyl-2-piperidyl)methoxy]-1-p-cumenyl-pyrazole-4-carboxylic acid Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)O)OCC3CCCCN3C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)O)OCC3CCCCN3C

InChI

InChI=1S/C20H27N3O3/c1-14(2)15-7-9-16(10-8-15)23-19(18(12-21-23)20(24)25)26-13-17-6-4-5-11-22(17)3/h7-10,12,14,17H,4-6,11,13H2,1-3H3,(H,24,25)