butyl 3-[[furan-2-yl-(8-oxidanylquinolin-7-yl)methyl]amino]benzoate

Systemtic Name: butyl 3-[[furan-2-yl-(8-oxidanylquinolin-7-yl)methyl]amino]benzoate Openeye Name: butyl 3-[[2-furyl-(8-hydroxy-7-quinolyl)methyl]amino]benzoate CAS Name: 3-[[2-furanyl-(8-hydroxy-7-quinolinyl)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[[furan-2-yl-(8-hydroxyquinolin-7-yl)methyl]amino]benzoate Traditional Name: 3-[[2-furyl-(8-hydroxy-7-quinolyl)methyl]amino]benzoic acid butyl ester Formula: C25H24N2O4 MolecularWeight: 416.46906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CO4

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CO4

InChI

InChI=1S/C25H24N2O4/c1-2-3-14-31-25(29)18-7-4-9-19(16-18)27-23(21-10-6-15-30-21)20-12-11-17-8-5-13-26-22(17)24(20)28/h4-13,15-16,23,27-28H,2-3,14H2,1H3