2-[[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carbonyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[[1-(2,4-dimethylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carbonyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[1-(2,4-dimethylphenyl)sulfonylisonipecotoyl]amino]ethyl-diisopropyl-ammonium Formula: C22H38N3O3S+ MolecularWeight: 424.62042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC[NH+](C(C)C)C(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC[NH+](C(C)C)C(C)C)C

InChI

InChI=1S/C22H37N3O3S/c1-16(2)25(17(3)4)14-11-23-22(26)20-9-12-24(13-10-20)29(27,28)21-8-7-18(5)15-19(21)6/h7-8,15-17,20H,9-14H2,1-6H3,(H,23,26)/p+1