N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloranyl-isoquinoline-3-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloranyl-isoquinoline-3-carboxamide Openeye Name: 6-chloro-N-quinuclidin-3-yl-isoquinoline-3-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloro-3-isoquinolinecarboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloroisoquinoline-3-carboxamide Traditional Name: 6-chloro-N-quinuclidin-3-yl-isoquinoline-3-carboxamide Formula: C17H18ClN3O MolecularWeight: 315.79732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=NC=C4C=CC(=CC4=C3)Cl

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=NC=C4C=CC(=CC4=C3)Cl

InChI

InChI=1S/C17H18ClN3O/c18-14-2-1-12-9-19-15(8-13(12)7-14)17(22)20-16-10-21-5-3-11(16)4-6-21/h1-2,7-9,11,16H,3-6,10H2,(H,20,22)