[3-[[1-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]carbonylamino]-2,2-dimethyl-propyl]-dimethyl-azanium

Systemtic Name: [3-[[1-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]carbonylamino]-2,2-dimethyl-propyl]-dimethyl-azanium Openeye Name: [3-[[1-(5-chloro-2-methoxy-phenyl)sulfonylpiperidine-4-carbonyl]amino]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[[[1-(5-chloro-2-methoxyphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[[1-(5-chloro-2-methoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[[1-(5-chloro-2-methoxy-phenyl)sulfonylisonipecotoyl]amino]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C20H33ClN3O4S+ MolecularWeight: 447.01172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)Cl)OC)C[NH+](C)C

Isomeric SMILES

CC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)Cl)OC)C[NH+](C)C

InChI

InChI=1S/C20H32ClN3O4S/c1-20(2,14-23(3)4)13-22-19(25)15-8-10-24(11-9-15)29(26,27)18-12-16(21)6-7-17(18)28-5/h6-7,12,15H,8-11,13-14H2,1-5H3,(H,22,25)/p+1