[7-chloranyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl-[(4-fluorophenyl)methyl]azanium

Systemtic Name: [7-chloranyl-2-oxidanylidene-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl-[(4-fluorophenyl)methyl]azanium Openeye Name: [7-chloro-2-oxo-1-(2-pyridylmethyl)-3-quinolyl]methyl-[(4-fluorophenyl)methyl]ammonium CAS Name: [7-chloro-2-oxo-1-(2-pyridinylmethyl)-3-quinolinyl]methyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: [7-chloro-2-oxo-1-(pyridin-2-ylmethyl)quinolin-3-yl]methyl-[(4-fluorophenyl)methyl]azanium Traditional Name: [7-chloro-2-keto-1-(2-pyridylmethyl)-3-quinolyl]methyl-(4-fluorobenzyl)ammonium Formula: C23H20ClFN3O+ MolecularWeight: 408.875803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN2C3=C(C=CC(=C3)Cl)C=C(C2=O)C[NH2+]CC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=NC(=C1)CN2C3=C(C=CC(=C3)Cl)C=C(C2=O)C[NH2+]CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H19ClFN3O/c24-19-7-6-17-11-18(14-26-13-16-4-8-20(25)9-5-16)23(29)28(22(17)12-19)15-21-3-1-2-10-27-21/h1-12,26H,13-15H2/p+1