(6-fluoranylquinolin-2-yl)methyl-(3-imidazol-1-ylpropyl)-[(5-methylfuran-2-yl)methyl]azanium

Systemtic Name: (6-fluoranylquinolin-2-yl)methyl-(3-imidazol-1-ylpropyl)-[(5-methylfuran-2-yl)methyl]azanium Openeye Name: (6-fluoro-2-quinolyl)methyl-(3-imidazol-1-ylpropyl)-[(5-methyl-2-furyl)methyl]ammonium CAS Name: (6-fluoro-2-quinolinyl)methyl-[3-(1-imidazolyl)propyl]-[(5-methyl-2-furanyl)methyl]ammonium IUPAC Name: (6-fluoroquinolin-2-yl)methyl-(3-imidazol-1-ylpropyl)-[(5-methylfuran-2-yl)methyl]azanium Traditional Name: (6-fluoro-2-quinolyl)methyl-(3-imidazol-1-ylpropyl)-[(5-methyl-2-furyl)methyl]ammonium Formula: C22H24FN4O+ MolecularWeight: 379.450563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+](CCCN2C=CN=C2)CC3=NC4=C(C=C3)C=C(C=C4)F

Isomeric SMILES

CC1=CC=C(O1)C[NH+](CCCN2C=CN=C2)CC3=NC4=C(C=C3)C=C(C=C4)F

InChI

InChI=1S/C22H23FN4O/c1-17-3-7-21(28-17)15-27(11-2-10-26-12-9-24-16-26)14-20-6-4-18-13-19(23)5-8-22(18)25-20/h3-9,12-13,16H,2,10-11,14-15H2,1H3/p+1