N-(1-azabicyclo[3.2.1]octan-3-yl)-6-ethynyl-isoquinoline-3-carboxamide

Systemtic Name: N-(1-azabicyclo[3.2.1]octan-3-yl)-6-ethynyl-isoquinoline-3-carboxamide Openeye Name: N-(1-azabicyclo[3.2.1]octan-3-yl)-6-ethynyl-isoquinoline-3-carboxamide CAS Name: N-(1-azabicyclo[3.2.1]octan-3-yl)-6-ethynyl-3-isoquinolinecarboxamide IUPAC Name: N-(1-azabicyclo[3.2.1]octan-3-yl)-6-ethynylisoquinoline-3-carboxamide Traditional Name: N-(1-azabicyclo[3.2.1]octan-3-yl)-6-ethynyl-isoquinoline-3-carboxamide Formula: C19H19N3O MolecularWeight: 305.37366

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC2=CC(=NC=C2C=C1)C(=O)NC3CC4CCN(C4)C3

Isomeric SMILES

C#CC1=CC2=CC(=NC=C2C=C1)C(=O)NC3CC4CCN(C4)C3

InChI

InChI=1S/C19H19N3O/c1-2-13-3-4-15-10-20-18(9-16(15)7-13)19(23)21-17-8-14-5-6-22(11-14)12-17/h1,3-4,7,9-10,14,17H,5-6,8,11-12H2,(H,21,23)