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

Systemtic Name: (diphenylmethyl)-[[7-fluoranyl-2-oxidanylidene-1-(pyridin-3-ylmethyl)quinolin-3-yl]methyl]azanium Openeye Name: benzhydryl-[[7-fluoro-2-oxo-1-(3-pyridylmethyl)-3-quinolyl]methyl]ammonium CAS Name: (diphenylmethyl)-[[7-fluoro-2-oxo-1-(3-pyridinylmethyl)-3-quinolinyl]methyl]ammonium IUPAC Name: benzhydryl-[[7-fluoro-2-oxo-1-(pyridin-3-ylmethyl)quinolin-3-yl]methyl]azanium Traditional Name: benzhydryl-[[7-fluoro-2-keto-1-(3-pyridylmethyl)-3-quinolyl]methyl]ammonium Formula: C29H25FN3O+ MolecularWeight: 450.526703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)[NH2+]CC3=CC4=C(C=C(C=C4)F)N(C3=O)CC5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)[NH2+]CC3=CC4=C(C=C(C=C4)F)N(C3=O)CC5=CN=CC=C5

InChI

InChI=1S/C29H24FN3O/c30-26-14-13-24-16-25(29(34)33(27(24)17-26)20-21-8-7-15-31-18-21)19-32-28(22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-18,28,32H,19-20H2/p+1