N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)-(4-nitrophenyl)methyl]pyridine-3-carboxamide

Systemtic Name: N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)-(4-nitrophenyl)methyl]pyridine-3-carboxamide Openeye Name: N-[(5-chloro-8-hydroxy-7-quinolyl)-(4-nitrophenyl)methyl]pyridine-3-carboxamide CAS Name: N-[(5-chloro-8-hydroxy-7-quinolinyl)-(4-nitrophenyl)methyl]-3-pyridinecarboxamide IUPAC Name: N-[(5-chloro-8-hydroxyquinolin-7-yl)-(4-nitrophenyl)methyl]pyridine-3-carboxamide Traditional Name: N-[(5-chloro-8-hydroxy-7-quinolyl)-(4-nitrophenyl)methyl]nicotinamide Formula: C22H15ClN4O4 MolecularWeight: 434.8319

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NC(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=C4C=CC=NC4=C3O)Cl

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NC(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=C4C=CC=NC4=C3O)Cl

InChI

InChI=1S/C22H15ClN4O4/c23-18-11-17(21(28)20-16(18)4-2-10-25-20)19(13-5-7-15(8-6-13)27(30)31)26-22(29)14-3-1-9-24-12-14/h1-12,19,28H,(H,26,29)