N-(5-chloranyl-2-phenoxy-phenyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-phenoxy-phenyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-phenoxy-phenyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: N-(5-chloro-2-phenoxyphenyl)-1-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-phenoxyphenyl)-1-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: N-(5-chloro-2-phenoxy-phenyl)-1-(2-pyrimidyl)isonipecotamide Formula: C22H21ClN4O2 MolecularWeight: 408.88074

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3)C4=NC=CC=N4

InChI

InChI=1S/C22H21ClN4O2/c23-17-7-8-20(29-18-5-2-1-3-6-18)19(15-17)26-21(28)16-9-13-27(14-10-16)22-24-11-4-12-25-22/h1-8,11-12,15-16H,9-10,13-14H2,(H,26,28)