2-[[2-(dimethylamino)-8-methyl-quinolin-1-ium-3-yl]methyl-propanoyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[2-(dimethylamino)-8-methyl-quinolin-1-ium-3-yl]methyl-propanoyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-(dimethylamino)-8-methyl-quinolin-1-ium-3-yl]methyl-propanoyl-amino]ethyl-dimethyl-ammonium CAS Name: 2-[[2-(dimethylamino)-8-methyl-3-quinolin-1-iumyl]methyl-(1-oxopropyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-(dimethylamino)-8-methylquinolin-1-ium-3-yl]methyl-propanoylamino]ethyl-dimethylazanium Traditional Name: 2-[[2-(dimethylamino)-8-methyl-quinolin-1-ium-3-yl]methyl-propionyl-amino]ethyl-dimethyl-ammonium Formula: C20H32N4O+2 MolecularWeight: 344.49428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC[NH+](C)C)CC1=C([NH+]=C2C(=CC=CC2=C1)C)N(C)C

Isomeric SMILES

CCC(=O)N(CC[NH+](C)C)CC1=C([NH+]=C2C(=CC=CC2=C1)C)N(C)C

InChI

InChI=1S/C20H30N4O/c1-7-18(25)24(12-11-22(3)4)14-17-13-16-10-8-9-15(2)19(16)21-20(17)23(5)6/h8-10,13H,7,11-12,14H2,1-6H3/p+2