2-[[2-(dimethylamino)-5,6,7-trimethoxy-quinolin-1-ium-3-yl]methyl-(2-ethylbutanoyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[2-(dimethylamino)-5,6,7-trimethoxy-quinolin-1-ium-3-yl]methyl-(2-ethylbutanoyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-(dimethylamino)-5,6,7-trimethoxy-quinolin-1-ium-3-yl]methyl-(2-ethylbutanoyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[2-(dimethylamino)-5,6,7-trimethoxy-3-quinolin-1-iumyl]methyl-(2-ethyl-1-oxobutyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-(dimethylamino)-5,6,7-trimethoxyquinolin-1-ium-3-yl]methyl-(2-ethylbutanoyl)amino]ethyl-dimethylazanium Traditional Name: 2-[[2-(dimethylamino)-5,6,7-trimethoxy-quinolin-1-ium-3-yl]methyl-(2-ethylbutanoyl)amino]ethyl-dimethyl-ammonium Formula: C25H42N4O4+2 MolecularWeight: 462.62538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N(CC[NH+](C)C)CC1=C([NH+]=C2C=C(C(=C(C2=C1)OC)OC)OC)N(C)C

Isomeric SMILES

CCC(CC)C(=O)N(CC[NH+](C)C)CC1=C([NH+]=C2C=C(C(=C(C2=C1)OC)OC)OC)N(C)C

InChI

InChI=1S/C25H40N4O4/c1-10-17(11-2)25(30)29(13-12-27(3)4)16-18-14-19-20(26-24(18)28(5)6)15-21(31-7)23(33-9)22(19)32-8/h14-15,17H,10-13,16H2,1-9H3/p+2