3-[[5-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]-2-piperidin-1-yl-phenyl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[5-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]-2-piperidin-1-yl-phenyl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[5-[(3-chloro-2,2-dimethyl-propanoyl)amino]-2-(1-piperidyl)benzoyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[5-[(3-chloro-2,2-dimethyl-1-oxopropyl)amino]-2-(1-piperidinyl)phenyl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[5-[(3-chloro-2,2-dimethylpropanoyl)amino]-2-piperidin-1-ylbenzoyl]amino]propyl-dimethylazanium Traditional Name: 3-[[5-[(3-chloro-2,2-dimethyl-propanoyl)amino]-2-piperidino-benzoyl]amino]propyl-dimethyl-ammonium Formula: C22H36ClN4O2+ MolecularWeight: 423.99984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)C(=O)NC1=CC(=C(C=C1)N2CCCCC2)C(=O)NCCC[NH+](C)C

Isomeric SMILES

CC(C)(CCl)C(=O)NC1=CC(=C(C=C1)N2CCCCC2)C(=O)NCCC[NH+](C)C

InChI

InChI=1S/C22H35ClN4O2/c1-22(2,16-23)21(29)25-17-9-10-19(27-13-6-5-7-14-27)18(15-17)20(28)24-11-8-12-26(3)4/h9-10,15H,5-8,11-14,16H2,1-4H3,(H,24,28)(H,25,29)/p+1