[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxylate

Systemtic Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxylate Openeye Name: [2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl] 1-phenyl-3-(3-pyridyl)pyrazole-4-carboxylate CAS Name: 1-phenyl-3-(3-pyridinyl)-4-pyrazolecarboxylic acid [2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl] 1-phenyl-3-pyridin-3-ylpyrazole-4-carboxylate Traditional Name: 1-phenyl-3-(3-pyridyl)pyrazole-4-carboxylic acid [2-(2,6-dimethylpiperidino)-2-keto-ethyl] ester Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)COC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1CCCC(N1C(=O)COC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C24H26N4O3/c1-17-8-6-9-18(2)28(17)22(29)16-31-24(30)21-15-27(20-11-4-3-5-12-20)26-23(21)19-10-7-13-25-14-19/h3-5,7,10-15,17-18H,6,8-9,16H2,1-2H3