(4-chlorophenyl)methyl 4-[(1H-pyrazol-5-ylcarbonylamino)methyl]piperidine-1-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 4-[(1H-pyrazol-5-ylcarbonylamino)methyl]piperidine-1-carboxylate Openeye Name: (4-chlorophenyl)methyl 4-[(1H-pyrazole-5-carbonylamino)methyl]piperidine-1-carboxylate CAS Name: 4-[[[oxo(1H-pyrazol-5-yl)methyl]amino]methyl]-1-piperidinecarboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 4-[(1H-pyrazole-5-carbonylamino)methyl]piperidine-1-carboxylate Traditional Name: 4-[(1H-pyrazole-5-carbonylamino)methyl]piperidine-1-carboxylic acid (4-chlorobenzyl) ester Formula: C18H21ClN4O3 MolecularWeight: 376.83734

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C2=CC=NN2)C(=O)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1CNC(=O)C2=CC=NN2)C(=O)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H21ClN4O3/c19-15-3-1-14(2-4-15)12-26-18(25)23-9-6-13(7-10-23)11-20-17(24)16-5-8-21-22-16/h1-5,8,13H,6-7,9-12H2,(H,20,24)(H,21,22)