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

Systemtic Name: N-(1-azabicyclo[3.2.1]octan-3-yl)-6-methyl-isoquinoline-3-carboxamide Openeye Name: N-(1-azabicyclo[3.2.1]octan-3-yl)-6-methyl-isoquinoline-3-carboxamide CAS Name: N-(1-azabicyclo[3.2.1]octan-3-yl)-6-methyl-3-isoquinolinecarboxamide IUPAC Name: N-(1-azabicyclo[3.2.1]octan-3-yl)-6-methylisoquinoline-3-carboxamide Traditional Name: N-(1-azabicyclo[3.2.1]octan-3-yl)-6-methyl-isoquinoline-3-carboxamide Formula: C18H21N3O MolecularWeight: 295.37884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O/c1-12-2-3-14-9-19-17(8-15(14)6-12)18(22)20-16-7-13-4-5-21(10-13)11-16/h2-3,6,8-9,13,16H,4-5,7,10-11H2,1H3,(H,20,22)