(7-fluoranyl-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl-[(3,4,5-trimethoxyphenyl)methyl]azanium

Systemtic Name: (7-fluoranyl-2-morpholin-4-yl-quinolin-1-ium-3-yl)methyl-[(3,4,5-trimethoxyphenyl)methyl]azanium Openeye Name: (7-fluoro-2-morpholino-quinolin-1-ium-3-yl)methyl-[(3,4,5-trimethoxyphenyl)methyl]ammonium CAS Name: [7-fluoro-2-(4-morpholinyl)-3-quinolin-1-iumyl]methyl-[(3,4,5-trimethoxyphenyl)methyl]ammonium IUPAC Name: (7-fluoro-2-morpholin-4-ylquinolin-1-ium-3-yl)methyl-[(3,4,5-trimethoxyphenyl)methyl]azanium Traditional Name: (7-fluoro-2-morpholino-quinolin-1-ium-3-yl)methyl-(3,4,5-trimethoxybenzyl)ammonium Formula: C24H30FN3O4+2 MolecularWeight: 443.511103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C[NH2+]CC2=C([NH+]=C3C=C(C=CC3=C2)F)N4CCOCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C[NH2+]CC2=C([NH+]=C3C=C(C=CC3=C2)F)N4CCOCC4

InChI

InChI=1S/C24H28FN3O4/c1-29-21-10-16(11-22(30-2)23(21)31-3)14-26-15-18-12-17-4-5-19(25)13-20(17)27-24(18)28-6-8-32-9-7-28/h4-5,10-13,26H,6-9,14-15H2,1-3H3/p+2