(2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl) 5-phenyl-1H-pyrazole-4-carboxylate

Systemtic Name: (2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl) 5-phenyl-1H-pyrazole-4-carboxylate Openeye Name: [2-oxo-1-phenyl-2-(1-piperidyl)ethyl] 5-phenyl-1H-pyrazole-4-carboxylate CAS Name: 5-phenyl-1H-pyrazole-4-carboxylic acid [2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-1-phenyl-2-piperidin-1-ylethyl) 5-phenyl-1H-pyrazole-4-carboxylate Traditional Name: 5-phenyl-1H-pyrazole-4-carboxylic acid (2-keto-1-phenyl-2-piperidino-ethyl) ester Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)OC(=O)C3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)OC(=O)C3=C(NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O3/c27-22(26-14-8-3-9-15-26)21(18-12-6-2-7-13-18)29-23(28)19-16-24-25-20(19)17-10-4-1-5-11-17/h1-2,4-7,10-13,16,21H,3,8-9,14-15H2,(H,24,25)