2-[[3-chloranyl-4-[1-[(2R)-5-methylhex-5-en-2-yl]piperidin-1-ium-4-yl]oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-chloranyl-4-[1-[(2R)-5-methylhex-5-en-2-yl]piperidin-1-ium-4-yl]oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-chloro-4-[1-[(1R)-1,4-dimethylpent-4-enyl]piperidin-1-ium-4-yl]oxy-benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-chloro-4-[[1-[(2R)-5-methylhex-5-en-2-yl]-4-piperidin-1-iumyl]oxy]phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-chloro-4-[1-[(2R)-5-methylhex-5-en-2-yl]piperidin-1-ium-4-yl]oxybenzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[3-chloro-4-[1-[(1R)-1,4-dimethylpent-4-enyl]piperidin-1-ium-4-yl]oxy-benzoyl]amino]ethyl-dimethyl-ammonium Formula: C23H38ClN3O2+2 MolecularWeight: 424.01972

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=C)C)[NH+]1CCC(CC1)OC2=C(C=C(C=C2)C(=O)NCC[NH+](C)C)Cl

Isomeric SMILES

C[C@H](CCC(=C)C)[NH+]1CCC(CC1)OC2=C(C=C(C=C2)C(=O)NCC[NH+](C)C)Cl

InChI

InChI=1S/C23H36ClN3O2/c1-17(2)6-7-18(3)27-13-10-20(11-14-27)29-22-9-8-19(16-21(22)24)23(28)25-12-15-26(4)5/h8-9,16,18,20H,1,6-7,10-15H2,2-5H3,(H,25,28)/p+2/t18-/m1/s1