N-(4-chloranyl-2,5-dimethoxy-phenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C20H21ClN4O3 MolecularWeight: 400.85874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N)OC)Cl

InChI

InChI=1S/C20H21ClN4O3/c1-27-17-10-16(18(28-2)9-15(17)21)24-20(26)14-5-7-25(8-6-14)19-4-3-13(11-22)12-23-19/h3-4,9-10,12,14H,5-8H2,1-2H3,(H,24,26)