dimethyl-[3-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonylamino]propyl]azanium Openeye Name: dimethyl-[3-[[1-(p-tolylsulfonyl)piperidine-4-carbonyl]amino]propyl]ammonium CAS Name: dimethyl-[3-[[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]amino]propyl]azanium Traditional Name: dimethyl-[3-[(1-tosylisonipecotoyl)amino]propyl]ammonium Formula: C18H30N3O3S+ MolecularWeight: 368.5141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O3S/c1-15-5-7-17(8-6-15)25(23,24)21-13-9-16(10-14-21)18(22)19-11-4-12-20(2)3/h5-8,16H,4,9-14H2,1-3H3,(H,19,22)/p+1