ethyl 4-[(3-methoxyphenyl)methyl]-1-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxylate Openeye Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxylate CAS Name: 4-[(3-methoxyphenyl)methyl]-1-(1H-pyrazol-5-ylmethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxylate Traditional Name: 4-m-anisyl-1-(1H-pyrazol-5-ylmethyl)isonipecotic acid ethyl ester Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=CC=NN2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=CC=NN2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H27N3O3/c1-3-26-19(24)20(14-16-5-4-6-18(13-16)25-2)8-11-23(12-9-20)15-17-7-10-21-22-17/h4-7,10,13H,3,8-9,11-12,14-15H2,1-2H3,(H,21,22)