[4-[(2S)-2-methylpiperidin-1-yl]sulfonylphenyl]methylazanium

Systemtic Name: [4-[(2S)-2-methylpiperidin-1-yl]sulfonylphenyl]methylazanium Openeye Name: [4-[[(2S)-2-methyl-1-piperidyl]sulfonyl]phenyl]methylammonium CAS Name: [4-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]phenyl]methylammonium IUPAC Name: [4-[(2S)-2-methylpiperidin-1-yl]sulfonylphenyl]methylazanium Traditional Name: [4-[(2S)-2-methylpiperidino]sulfonylbenzyl]ammonium Formula: C13H21N2O2S+ MolecularWeight: 269.38304

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C[NH3+]

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C[NH3+]

InChI

InChI=1S/C13H20N2O2S/c1-11-4-2-3-9-15(11)18(16,17)13-7-5-12(10-14)6-8-13/h5-8,11H,2-4,9-10,14H2,1H3/p+1/t11-/m0/s1