methyl 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]carbonyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]carbonyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-oxomethyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]-4-phenyl-isonipecotic acid methyl ester Formula: C23H22FN3O3 MolecularWeight: 407.437483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)C(=O)C2=C(NN=C2)C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1(CCN(CC1)C(=O)C2=C(NN=C2)C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C23H22FN3O3/c1-30-22(29)23(17-5-3-2-4-6-17)11-13-27(14-12-23)21(28)19-15-25-26-20(19)16-7-9-18(24)10-8-16/h2-10,15H,11-14H2,1H3,(H,25,26)