N-tert-butyl-2-[ethyl-(8-nitroisoquinolin-5-yl)amino]ethanamide

Systemtic Name: N-tert-butyl-2-[ethyl-(8-nitroisoquinolin-5-yl)amino]ethanamide Openeye Name: N-tert-butyl-2-[ethyl-(8-nitro-5-isoquinolyl)amino]acetamide CAS Name: N-tert-butyl-2-[ethyl-(8-nitro-5-isoquinolinyl)amino]acetamide IUPAC Name: N-tert-butyl-2-[ethyl-(8-nitroisoquinolin-5-yl)amino]acetamide Traditional Name: N-tert-butyl-2-[ethyl-(8-nitro-5-isoquinolyl)amino]acetamide Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC(C)(C)C)C1=C2C=CN=CC2=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCN(CC(=O)NC(C)(C)C)C1=C2C=CN=CC2=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O3/c1-5-20(11-16(22)19-17(2,3)4)14-6-7-15(21(23)24)13-10-18-9-8-12(13)14/h6-10H,5,11H2,1-4H3,(H,19,22)