N-isoquinolin-5-yl-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-isoquinolin-5-yl-2-(2-nitrophenoxy)ethanamide Openeye Name: N-(5-isoquinolyl)-2-(2-nitrophenoxy)acetamide CAS Name: N-(5-isoquinolinyl)-2-(2-nitrophenoxy)acetamide IUPAC Name: N-isoquinolin-5-yl-2-(2-nitrophenoxy)acetamide Traditional Name: N-(5-isoquinolyl)-2-(2-nitrophenoxy)acetamide Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C17H13N3O4/c21-17(11-24-16-7-2-1-6-15(16)20(22)23)19-14-5-3-4-12-10-18-9-8-13(12)14/h1-10H,11H2,(H,19,21)