2-(dimethylamino)-5-nitro-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide

Systemtic Name: 2-(dimethylamino)-5-nitro-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Openeye Name: 2-(dimethylamino)-5-nitro-N-[5-(1-piperidyl)-8-isoquinolyl]benzamide CAS Name: 2-(dimethylamino)-5-nitro-N-[5-(1-piperidinyl)-8-isoquinolinyl]benzamide IUPAC Name: 2-(dimethylamino)-5-nitro-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Traditional Name: 2-(dimethylamino)-5-nitro-N-(5-piperidino-8-isoquinolyl)benzamide Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

InChI

InChI=1S/C23H25N5O3/c1-26(2)21-8-6-16(28(30)31)14-18(21)23(29)25-20-7-9-22(27-12-4-3-5-13-27)17-10-11-24-15-19(17)20/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,25,29)