3-methyl-1-phenyl-5-piperidin-1-yl-pyrazole-4-carboxylic acid

Systemtic Name: 3-methyl-1-phenyl-5-piperidin-1-yl-pyrazole-4-carboxylic acid Openeye Name: 3-methyl-1-phenyl-5-(1-piperidyl)pyrazole-4-carboxylic acid CAS Name: 3-methyl-1-phenyl-5-(1-piperidinyl)-4-pyrazolecarboxylic acid IUPAC Name: 3-methyl-1-phenyl-5-piperidin-1-ylpyrazole-4-carboxylic acid Traditional Name: 3-methyl-1-phenyl-5-piperidino-pyrazole-4-carboxylic acid Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)N2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)N2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3O2/c1-12-14(16(20)21)15(18-10-6-3-7-11-18)19(17-12)13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-11H2,1H3,(H,20,21)