hexyl 4-[[furan-2-yl-(8-oxidanylquinolin-7-yl)methyl]amino]benzoate

Systemtic Name: hexyl 4-[[furan-2-yl-(8-oxidanylquinolin-7-yl)methyl]amino]benzoate Openeye Name: hexyl 4-[[2-furyl-(8-hydroxy-7-quinolyl)methyl]amino]benzoate CAS Name: 4-[[2-furanyl-(8-hydroxy-7-quinolinyl)methyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[furan-2-yl-(8-hydroxyquinolin-7-yl)methyl]amino]benzoate Traditional Name: 4-[[2-furyl-(8-hydroxy-7-quinolyl)methyl]amino]benzoic acid hexyl ester Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N2O4/c1-2-3-4-5-17-33-27(31)20-10-13-21(14-11-20)29-25(23-9-7-18-32-23)22-15-12-19-8-6-16-28-24(19)26(22)30/h6-16,18,25,29-30H,2-5,17H2,1H3