butyl-[[6-(diethylamino)-2-methyl-4-oxidanyl-quinolin-1-ium-3-yl]methyl]-methyl-azanium

Systemtic Name: butyl-[[6-(diethylamino)-2-methyl-4-oxidanyl-quinolin-1-ium-3-yl]methyl]-methyl-azanium Openeye Name: butyl-[[6-(diethylamino)-4-hydroxy-2-methyl-quinolin-1-ium-3-yl]methyl]-methyl-ammonium CAS Name: butyl-[[6-(diethylamino)-4-hydroxy-2-methyl-3-quinolin-1-iumyl]methyl]-methylammonium IUPAC Name: butyl-[[6-(diethylamino)-4-hydroxy-2-methylquinolin-1-ium-3-yl]methyl]-methylazanium Traditional Name: butyl-[[6-(diethylamino)-4-hydroxy-2-methyl-quinolin-1-ium-3-yl]methyl]-methyl-ammonium Formula: C20H33N3O+2 MolecularWeight: 331.49552

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=C(C2=C(C=CC(=C2)N(CC)CC)[NH+]=C1C)O

Isomeric SMILES

CCCC[NH+](C)CC1=C(C2=C(C=CC(=C2)N(CC)CC)[NH+]=C1C)O

InChI

InChI=1S/C20H31N3O/c1-6-9-12-22(5)14-18-15(4)21-19-11-10-16(23(7-2)8-3)13-17(19)20(18)24/h10-11,13H,6-9,12,14H2,1-5H3,(H,21,24)/p+2