2-[[3-chloranyl-4-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-chloranyl-4-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-chloro-4-[[1-(1-methylpiperidin-1-ium-4-yl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-chloro-4-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidinyl]oxy]phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-chloro-4-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxybenzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[3-chloro-4-[[1-(1-methylpiperidin-1-ium-4-yl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium Formula: C22H37ClN4O2+2 MolecularWeight: 425.00778

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CCC(CC2)OC3=C(C=C(C=C3)C(=O)NCC[NH+](C)C)Cl

Isomeric SMILES

C[NH+]1CCC(CC1)N2CCC(CC2)OC3=C(C=C(C=C3)C(=O)NCC[NH+](C)C)Cl

InChI

InChI=1S/C22H35ClN4O2/c1-25(2)15-10-24-22(28)17-4-5-21(20(23)16-17)29-19-8-13-27(14-9-19)18-6-11-26(3)12-7-18/h4-5,16,18-19H,6-15H2,1-3H3,(H,24,28)/p+2