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

Systemtic Name: ethyl 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-(3-phenylpropyl)piperidine-4-carboxylate Openeye Name: ethyl 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-(3-phenylpropyl)piperidine-4-carboxylate CAS Name: 1-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-4-(3-phenylpropyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-4-(3-phenylpropyl)piperidine-4-carboxylate Traditional Name: 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-(3-phenylpropyl)isonipecotic acid ethyl ester Formula: C24H35N3O2 MolecularWeight: 397.5536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CN2CCC(CC2)(CCCC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=N1)C)CN2CCC(CC2)(CCCC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C24H35N3O2/c1-4-27-19-22(20(3)25-27)18-26-16-14-24(15-17-26,23(28)29-5-2)13-9-12-21-10-7-6-8-11-21/h6-8,10-11,19H,4-5,9,12-18H2,1-3H3