1-(isoquinolin-5-ylmethyl)-N-(6-phenoxypyridin-3-yl)piperidine-4-carboxamide

Systemtic Name: 1-(isoquinolin-5-ylmethyl)-N-(6-phenoxypyridin-3-yl)piperidine-4-carboxamide Openeye Name: 1-(5-isoquinolylmethyl)-N-(6-phenoxy-3-pyridyl)piperidine-4-carboxamide CAS Name: 1-(5-isoquinolinylmethyl)-N-(6-phenoxy-3-pyridinyl)-4-piperidinecarboxamide IUPAC Name: 1-(isoquinolin-5-ylmethyl)-N-(6-phenoxypyridin-3-yl)piperidine-4-carboxamide Traditional Name: 1-(5-isoquinolylmethyl)-N-(6-phenoxy-3-pyridyl)isonipecotamide Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CN=C(C=C2)OC3=CC=CC=C3)CC4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CN=C(C=C2)OC3=CC=CC=C3)CC4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C27H26N4O2/c32-27(30-23-9-10-26(29-18-23)33-24-7-2-1-3-8-24)20-12-15-31(16-13-20)19-22-6-4-5-21-17-28-14-11-25(21)22/h1-11,14,17-18,20H,12-13,15-16,19H2,(H,30,32)