methyl 1-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[3-(4-methoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(4-methoxyphenyl)-1-phenylpyrazole-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[3-(4-methoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]isonipecotic acid methyl ester Formula: C24H25N3O4 MolecularWeight: 419.473

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCC(CC3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCC(CC3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C24H25N3O4/c1-30-20-10-8-17(9-11-20)22-21(16-27(25-22)19-6-4-3-5-7-19)23(28)26-14-12-18(13-15-26)24(29)31-2/h3-11,16,18H,12-15H2,1-2H3