(4-chlorophenyl)methyl 4-[(pyridin-4-ylcarbonylamino)methyl]piperidine-1-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 4-[(pyridin-4-ylcarbonylamino)methyl]piperidine-1-carboxylate Openeye Name: (4-chlorophenyl)methyl 4-[(pyridine-4-carbonylamino)methyl]piperidine-1-carboxylate CAS Name: 4-[[[oxo(pyridin-4-yl)methyl]amino]methyl]-1-piperidinecarboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 4-[(pyridine-4-carbonylamino)methyl]piperidine-1-carboxylate Traditional Name: 4-(isonicotinamidomethyl)piperidine-1-carboxylic acid (4-chlorobenzyl) ester Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O3/c21-18-3-1-16(2-4-18)14-27-20(26)24-11-7-15(8-12-24)13-23-19(25)17-5-9-22-10-6-17/h1-6,9-10,15H,7-8,11-14H2,(H,23,25)