2-(azepan-1-yl)-N-(6-methoxyquinolin-8-yl)-5-nitro-benzamide

Systemtic Name: 2-(azepan-1-yl)-N-(6-methoxyquinolin-8-yl)-5-nitro-benzamide Openeye Name: 2-(azepan-1-yl)-N-(6-methoxy-8-quinolyl)-5-nitro-benzamide CAS Name: 2-(1-azepanyl)-N-(6-methoxy-8-quinolinyl)-5-nitrobenzamide IUPAC Name: 2-(azepan-1-yl)-N-(6-methoxyquinolin-8-yl)-5-nitrobenzamide Traditional Name: 2-(azepan-1-yl)-N-(6-methoxy-8-quinolyl)-5-nitro-benzamide Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C=CC=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCCCCC4

Isomeric SMILES

COC1=CC(=C2C(=C1)C=CC=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCCCCC4

InChI

InChI=1S/C23H24N4O4/c1-31-18-13-16-7-6-10-24-22(16)20(15-18)25-23(28)19-14-17(27(29)30)8-9-21(19)26-11-4-2-3-5-12-26/h6-10,13-15H,2-5,11-12H2,1H3,(H,25,28)