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

Systemtic Name: [2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl] 5-phenyl-1H-pyrazole-4-carboxylate Openeye Name: [2-(4-benzyl-1-piperidyl)-2-oxo-ethyl] 5-phenyl-1H-pyrazole-4-carboxylate CAS Name: 5-phenyl-1H-pyrazole-4-carboxylic acid [2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl] ester IUPAC Name: [2-(4-benzylpiperidin-1-yl)-2-oxoethyl] 5-phenyl-1H-pyrazole-4-carboxylate Traditional Name: 5-phenyl-1H-pyrazole-4-carboxylic acid [2-(4-benzylpiperidino)-2-keto-ethyl] ester Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)COC(=O)C3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)COC(=O)C3=C(NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H25N3O3/c28-22(27-13-11-19(12-14-27)15-18-7-3-1-4-8-18)17-30-24(29)21-16-25-26-23(21)20-9-5-2-6-10-20/h1-10,16,19H,11-15,17H2,(H,25,26)