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

Systemtic Name: N-[2-[(8-nitroisoquinolin-5-yl)amino]ethyl]ethanamide Openeye Name: N-[2-[(8-nitro-5-isoquinolyl)amino]ethyl]acetamide CAS Name: N-[2-[(8-nitro-5-isoquinolinyl)amino]ethyl]acetamide IUPAC Name: N-[2-[(8-nitroisoquinolin-5-yl)amino]ethyl]acetamide Traditional Name: N-[2-[(8-nitro-5-isoquinolyl)amino]ethyl]acetamide Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=C2C=CN=CC2=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NCCNC1=C2C=CN=CC2=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O3/c1-9(18)15-6-7-16-12-2-3-13(17(19)20)11-8-14-5-4-10(11)12/h2-5,8,16H,6-7H2,1H3,(H,15,18)