N-(5-tert-butyl-2-methoxy-phenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C23H28N4O2/c1-23(2,3)18-6-7-20(29-4)19(13-18)26-22(28)17-9-11-27(12-10-17)21-8-5-16(14-24)15-25-21/h5-8,13,15,17H,9-12H2,1-4H3,(H,26,28)