6-(2-cyanoethyl)-N-[3-(dimethylamino)propyl]-1-oxidanylidene-2H-benzo[h]isoquinoline-9-carboxamide

Systemtic Name: 6-(2-cyanoethyl)-N-[3-(dimethylamino)propyl]-1-oxidanylidene-2H-benzo[h]isoquinoline-9-carboxamide Openeye Name: 6-(2-cyanoethyl)-N-[3-(dimethylamino)propyl]-1-oxo-2H-benzo[h]isoquinoline-9-carboxamide CAS Name: 6-(2-cyanoethyl)-N-[3-(dimethylamino)propyl]-1-oxo-2H-benzo[h]isoquinoline-9-carboxamide IUPAC Name: 6-(2-cyanoethyl)-N-[3-(dimethylamino)propyl]-1-oxo-2H-benzo[h]isoquinoline-9-carboxamide Traditional Name: 6-(2-cyanoethyl)-N-[3-(dimethylamino)propyl]-1-keto-2H-benz[h]isoquinoline-9-carboxamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)C1=CC2=C3C(=CC(=C2C=C1)CCC#N)C=CNC3=O

Isomeric SMILES

CN(C)CCCNC(=O)C1=CC2=C3C(=CC(=C2C=C1)CCC#N)C=CNC3=O

InChI

InChI=1S/C22H24N4O2/c1-26(2)12-4-10-24-21(27)17-6-7-18-15(5-3-9-23)13-16-8-11-25-22(28)20(16)19(18)14-17/h6-8,11,13-14H,3-5,10,12H2,1-2H3,(H,24,27)(H,25,28)