(3,4-dimethoxyphenyl)methyl-[[7-fluoranyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-[[7-fluoranyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-[[7-fluoro-2-oxo-1-(2-pyridylmethyl)-3-quinolyl]methyl]ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-[[7-fluoro-2-oxo-1-(2-pyridinylmethyl)-3-quinolinyl]methyl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-[[7-fluoro-2-oxo-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl]azanium Traditional Name: [7-fluoro-2-keto-1-(2-pyridylmethyl)-3-quinolyl]methyl-veratryl-ammonium Formula: C25H25FN3O3+ MolecularWeight: 434.482703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]CC2=CC3=C(C=C(C=C3)F)N(C2=O)CC4=CC=CC=N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]CC2=CC3=C(C=C(C=C3)F)N(C2=O)CC4=CC=CC=N4)OC

InChI

InChI=1S/C25H24FN3O3/c1-31-23-9-6-17(11-24(23)32-2)14-27-15-19-12-18-7-8-20(26)13-22(18)29(25(19)30)16-21-5-3-4-10-28-21/h3-13,27H,14-16H2,1-2H3/p+1