2-(3,4-dimethoxyphenyl)ethyl-[(7-fluoranyl-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(7-fluoranyl-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(7-fluoro-2-morpholino-quinolin-1-ium-3-yl)methyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[[7-fluoro-2-(4-morpholinyl)-3-quinolin-1-iumyl]methyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(7-fluoro-2-morpholin-4-ylquinolin-1-ium-3-yl)methyl]azanium Traditional Name: (7-fluoro-2-morpholino-quinolin-1-ium-3-yl)methyl-homoveratryl-ammonium Formula: C24H30FN3O3+2 MolecularWeight: 427.511703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]CC2=C([NH+]=C3C=C(C=CC3=C2)F)N4CCOCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+]CC2=C([NH+]=C3C=C(C=CC3=C2)F)N4CCOCC4)OC

InChI

InChI=1S/C24H28FN3O3/c1-29-22-6-3-17(13-23(22)30-2)7-8-26-16-19-14-18-4-5-20(25)15-21(18)27-24(19)28-9-11-31-12-10-28/h3-6,13-15,26H,7-12,16H2,1-2H3/p+2