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

Systemtic Name: N-[1,3-benzodioxol-5-yl-(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]-3-methoxy-benzamide Openeye Name: N-[1,3-benzodioxol-5-yl-(5-chloro-8-hydroxy-7-quinolyl)methyl]-3-methoxy-benzamide CAS Name: N-[1,3-benzodioxol-5-yl-(5-chloro-8-hydroxy-7-quinolinyl)methyl]-3-methoxybenzamide IUPAC Name: N-[1,3-benzodioxol-5-yl-(5-chloro-8-hydroxyquinolin-7-yl)methyl]-3-methoxybenzamide Traditional Name: N-[1,3-benzodioxol-5-yl-(5-chloro-8-hydroxy-7-quinolyl)methyl]-3-methoxy-benzamide Formula: C25H19ClN2O5 MolecularWeight: 462.88176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(C2=CC3=C(C=C2)OCO3)C4=CC(=C5C=CC=NC5=C4O)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC(C2=CC3=C(C=C2)OCO3)C4=CC(=C5C=CC=NC5=C4O)Cl

InChI

InChI=1S/C25H19ClN2O5/c1-31-16-5-2-4-15(10-16)25(30)28-22(14-7-8-20-21(11-14)33-13-32-20)18-12-19(26)17-6-3-9-27-23(17)24(18)29/h2-12,22,29H,13H2,1H3,(H,28,30)