ethyl 3-(3-phenylpropyl)-1-(3-pyrazol-1-ylpropanoyl)piperidine-3-carboxylate

Systemtic Name: ethyl 3-(3-phenylpropyl)-1-(3-pyrazol-1-ylpropanoyl)piperidine-3-carboxylate Openeye Name: ethyl 3-(3-phenylpropyl)-1-(3-pyrazol-1-ylpropanoyl)piperidine-3-carboxylate CAS Name: 1-[1-oxo-3-(1-pyrazolyl)propyl]-3-(3-phenylpropyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-phenylpropyl)-1-(3-pyrazol-1-ylpropanoyl)piperidine-3-carboxylate Traditional Name: 3-(3-phenylpropyl)-1-(3-pyrazol-1-ylpropanoyl)nipecotic acid ethyl ester Formula: C23H31N3O3 MolecularWeight: 397.51054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)CCN2C=CC=N2)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)CCN2C=CC=N2)CCCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3/c1-2-29-22(28)23(13-6-11-20-9-4-3-5-10-20)14-7-16-25(19-23)21(27)12-18-26-17-8-15-24-26/h3-5,8-10,15,17H,2,6-7,11-14,16,18-19H2,1H3