2-chloranyl-N-isoquinolin-5-yl-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-isoquinolin-5-yl-4-nitro-benzamide Openeye Name: 2-chloro-N-(5-isoquinolyl)-4-nitro-benzamide CAS Name: 2-chloro-N-(5-isoquinolinyl)-4-nitrobenzamide IUPAC Name: 2-chloro-N-isoquinolin-5-yl-4-nitrobenzamide Traditional Name: 2-chloro-N-(5-isoquinolyl)-4-nitro-benzamide Formula: C16H10ClN3O3 MolecularWeight: 327.7219

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H10ClN3O3/c17-14-8-11(20(22)23)4-5-13(14)16(21)19-15-3-1-2-10-9-18-7-6-12(10)15/h1-9H,(H,19,21)