2-[(2,5-dimethoxyphenyl)carbonyl-[[2-(dimethylamino)-8-methyl-quinolin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2,5-dimethoxyphenyl)carbonyl-[[2-(dimethylamino)-8-methyl-quinolin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[(2,5-dimethoxybenzoyl)-[[2-(dimethylamino)-8-methyl-quinolin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2,5-dimethoxyphenyl)-oxomethyl]-[[2-(dimethylamino)-8-methyl-3-quinolin-1-iumyl]methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(2,5-dimethoxybenzoyl)-[[2-(dimethylamino)-8-methylquinolin-1-ium-3-yl]methyl]amino]ethyl-dimethylazanium Traditional Name: 2-[(2,5-dimethoxybenzoyl)-[[2-(dimethylamino)-8-methyl-quinolin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-ammonium Formula: C26H36N4O3+2 MolecularWeight: 452.58904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C([NH+]=C12)N(C)C)CN(CC[NH+](C)C)C(=O)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC=CC2=CC(=C([NH+]=C12)N(C)C)CN(CC[NH+](C)C)C(=O)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C26H34N4O3/c1-18-9-8-10-19-15-20(25(29(4)5)27-24(18)19)17-30(14-13-28(2)3)26(31)22-16-21(32-6)11-12-23(22)33-7/h8-12,15-16H,13-14,17H2,1-7H3/p+2