[4-[[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylmethyl]phenyl]methylazanium

Systemtic Name: [4-[[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylmethyl]phenyl]methylazanium Openeye Name: [4-[[(3S,5S)-3,5-dimethyl-1-piperidyl]sulfonylmethyl]phenyl]methylammonium CAS Name: [4-[[(3S,5S)-3,5-dimethyl-1-piperidinyl]sulfonylmethyl]phenyl]methylammonium IUPAC Name: [4-[[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylmethyl]phenyl]methylazanium Traditional Name: [4-[[(3S,5S)-3,5-dimethylpiperidino]sulfonylmethyl]benzyl]ammonium Formula: C15H25N2O2S+ MolecularWeight: 297.4362

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)CC2=CC=C(C=C2)C[NH3+])C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)S(=O)(=O)CC2=CC=C(C=C2)C[NH3+])C

InChI

InChI=1S/C15H24N2O2S/c1-12-7-13(2)10-17(9-12)20(18,19)11-15-5-3-14(8-16)4-6-15/h3-6,12-13H,7-11,16H2,1-2H3/p+1/t12-,13-/m0/s1