[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxylate

Systemtic Name: [2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxylate Openeye Name: [2-(3,5-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-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(3,5-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-(3,5-dimethylpiperidino)-2-keto-ethyl] ester Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)COC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)COC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C

InChI

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