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

Systemtic Name: 2-[[3-chloranyl-4-(1-cyclohexylpiperidin-1-ium-4-yl)oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-chloro-4-(1-cyclohexylpiperidin-1-ium-4-yl)oxy-benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-chloro-4-[(1-cyclohexyl-4-piperidin-1-iumyl)oxy]phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-chloro-4-(1-cyclohexylpiperidin-1-ium-4-yl)oxybenzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[3-chloro-4-(1-cyclohexylpiperidin-1-ium-4-yl)oxy-benzoyl]amino]ethyl-dimethyl-ammonium Formula: C22H36ClN3O2+2 MolecularWeight: 409.99314

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)OC2CC[NH+](CC2)C3CCCCC3)Cl

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)OC2CC[NH+](CC2)C3CCCCC3)Cl

InChI

InChI=1S/C22H34ClN3O2/c1-25(2)15-12-24-22(27)17-8-9-21(20(23)16-17)28-19-10-13-26(14-11-19)18-6-4-3-5-7-18/h8-9,16,18-19H,3-7,10-15H2,1-2H3,(H,24,27)/p+2