(7-chloranyl-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl-[2-(3-fluorophenyl)ethyl]azanium

Systemtic Name: (7-chloranyl-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl-[2-(3-fluorophenyl)ethyl]azanium Openeye Name: (7-chloro-2-morpholino-quinolin-1-ium-3-yl)methyl-[2-(3-fluorophenyl)ethyl]ammonium CAS Name: [7-chloro-2-(4-morpholinyl)-3-quinolin-1-iumyl]methyl-[2-(3-fluorophenyl)ethyl]ammonium IUPAC Name: (7-chloro-2-morpholin-4-ylquinolin-1-ium-3-yl)methyl-[2-(3-fluorophenyl)ethyl]azanium Traditional Name: (7-chloro-2-morpholino-quinolin-1-ium-3-yl)methyl-[2-(3-fluorophenyl)ethyl]ammonium Formula: C22H25ClFN3O+2 MolecularWeight: 401.904803

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C3C=CC(=CC3=[NH+]2)Cl)C[NH2+]CCC4=CC(=CC=C4)F

Isomeric SMILES

C1COCCN1C2=C(C=C3C=CC(=CC3=[NH+]2)Cl)C[NH2+]CCC4=CC(=CC=C4)F

InChI

InChI=1S/C22H23ClFN3O/c23-19-5-4-17-13-18(15-25-7-6-16-2-1-3-20(24)12-16)22(26-21(17)14-19)27-8-10-28-11-9-27/h1-5,12-14,25H,6-11,15H2/p+2