ethyl 3-(3-phenylpropyl)-1-[3-(1H-pyrazol-4-yl)propanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 3-(3-phenylpropyl)-1-[3-(1H-pyrazol-4-yl)propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 3-(3-phenylpropyl)-1-[3-(1H-pyrazol-4-yl)propanoyl]piperidine-3-carboxylate CAS Name: 1-[1-oxo-3-(1H-pyrazol-4-yl)propyl]-3-(3-phenylpropyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-phenylpropyl)-1-[3-(1H-pyrazol-4-yl)propanoyl]piperidine-3-carboxylate Traditional Name: 3-(3-phenylpropyl)-1-[3-(1H-pyrazol-4-yl)propanoyl]nipecotic acid ethyl ester Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)CCC2=CNN=C2)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)CCC2=CNN=C2)CCCC3=CC=CC=C3

InChI

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