2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3,3-dimethylbutan-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3,3-dimethylbutan-2-yl)quinoline-4-carboxamide Openeye Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(1,2,2-trimethylpropyl)quinoline-4-carboxamide CAS Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3,3-dimethylbutan-2-yl)-4-quinolinecarboxamide IUPAC Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(3,3-dimethylbutan-2-yl)quinoline-4-carboxamide Traditional Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(1,2,2-trimethylpropyl)cinchoninamide Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)NC(=O)C1=CC(=NC2=CC=CC=C21)N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

CC(C(C)(C)C)NC(=O)C1=CC(=NC2=CC=CC=C21)N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C27H33N3O3/c1-17(27(2,3)4)28-26(31)21-15-25(29-22-10-8-7-9-20(21)22)30-12-11-18-13-23(32-5)24(33-6)14-19(18)16-30/h7-10,13-15,17H,11-12,16H2,1-6H3,(H,28,31)