N-[1,3-benzodioxol-5-yl-(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]pyridine-3-carboxamide

Systemtic Name: N-[1,3-benzodioxol-5-yl-(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]pyridine-3-carboxamide Openeye Name: N-[1,3-benzodioxol-5-yl-(5-chloro-8-hydroxy-7-quinolyl)methyl]pyridine-3-carboxamide CAS Name: N-[1,3-benzodioxol-5-yl-(5-chloro-8-hydroxy-7-quinolinyl)methyl]-3-pyridinecarboxamide IUPAC Name: N-[1,3-benzodioxol-5-yl-(5-chloro-8-hydroxyquinolin-7-yl)methyl]pyridine-3-carboxamide Traditional Name: N-[1,3-benzodioxol-5-yl-(5-chloro-8-hydroxy-7-quinolyl)methyl]nicotinamide Formula: C23H16ClN3O4 MolecularWeight: 433.84384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C3=CC(=C4C=CC=NC4=C3O)Cl)NC(=O)C5=CN=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C3=CC(=C4C=CC=NC4=C3O)Cl)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C23H16ClN3O4/c24-17-10-16(22(28)21-15(17)4-2-8-26-21)20(27-23(29)14-3-1-7-25-11-14)13-5-6-18-19(9-13)31-12-30-18/h1-11,20,28H,12H2,(H,27,29)