ethyl 1-(4-methylphenyl)-5-[[[1-(phenylmethyl)piperidin-4-yl]amino]methyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-methylphenyl)-5-[[[1-(phenylmethyl)piperidin-4-yl]amino]methyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-[[(1-benzyl-4-piperidyl)amino]methyl]-1-(p-tolyl)pyrazole-4-carboxylate CAS Name: 1-(4-methylphenyl)-5-[[[1-(phenylmethyl)-4-piperidinyl]amino]methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(1-benzylpiperidin-4-yl)amino]methyl]-1-(4-methylphenyl)pyrazole-4-carboxylate Traditional Name: 5-[[(1-benzyl-4-piperidyl)amino]methyl]-1-(p-tolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C26H32N4O2 MolecularWeight: 432.55788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C)CNC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C)CNC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2/c1-3-32-26(31)24-17-28-30(23-11-9-20(2)10-12-23)25(24)18-27-22-13-15-29(16-14-22)19-21-7-5-4-6-8-21/h4-12,17,22,27H,3,13-16,18-19H2,1-2H3