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

Systemtic Name: N-(4-benzamido-2,5-dimethoxy-phenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-(4-benzamido-2,5-dimethoxy-phenyl)-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-(4-benzamido-2,5-dimethoxyphenyl)-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-(4-benzamido-2,5-dimethoxyphenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-(4-benzamido-2,5-dimethoxy-phenyl)-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C27H27N5O4/c1-35-23-15-22(24(36-2)14-21(23)30-26(33)19-6-4-3-5-7-19)31-27(34)20-10-12-32(13-11-20)25-9-8-18(16-28)17-29-25/h3-9,14-15,17,20H,10-13H2,1-2H3,(H,30,33)(H,31,34)