(2S,4S)-4-isoquinolin-6-yloxy-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide

Systemtic Name: (2S,4S)-4-isoquinolin-6-yloxy-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide Openeye Name: (2S,4S)-4-(6-isoquinolyloxy)-N-(2-pyridylmethyl)piperidine-2-carboxamide CAS Name: (2S,4S)-4-(6-isoquinolinyloxy)-N-(2-pyridinylmethyl)-2-piperidinecarboxamide IUPAC Name: (2S,4S)-4-isoquinolin-6-yloxy-N-(pyridin-2-ylmethyl)piperidine-2-carboxamide Traditional Name: (2S,4S)-4-(6-isoquinolyloxy)-N-(2-pyridylmethyl)pipecolinamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(CC1OC2=CC3=C(C=C2)C=NC=C3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

C1CN[C@@H](C[C@H]1OC2=CC3=C(C=C2)C=NC=C3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C21H22N4O2/c26-21(25-14-17-3-1-2-8-23-17)20-12-19(7-10-24-20)27-18-5-4-16-13-22-9-6-15(16)11-18/h1-6,8-9,11,13,19-20,24H,7,10,12,14H2,(H,25,26)/t19-,20-/m0/s1