(3-bromophenyl)-[(2S)-2-methylpiperidin-1-ium-1-yl]sulfonyl-azanide

Systemtic Name: (3-bromophenyl)-[(2S)-2-methylpiperidin-1-ium-1-yl]sulfonyl-azanide Openeye Name: (3-bromophenyl)-[(2S)-2-methylpiperidin-1-ium-1-yl]sulfonyl-azanide CAS Name: (3-bromophenyl)-[[(2S)-2-methyl-1-piperidin-1-iumyl]sulfonyl]azanide IUPAC Name: (3-bromophenyl)-[(2S)-2-methylpiperidin-1-ium-1-yl]sulfonylazanide Traditional Name: (3-bromophenyl)-[(2S)-2-methylpiperidin-1-ium-1-yl]sulfonyl-azanide Formula: C12H17BrN2O2S MolecularWeight: 333.24458

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1S(=O)(=O)[N-]C2=CC(=CC=C2)Br

Isomeric SMILES

C[C@H]1CCCC[NH+]1S(=O)(=O)[N-]C2=CC(=CC=C2)Br

InChI

InChI=1S/C12H16BrN2O2S/c1-10-5-2-3-8-15(10)18(16,17)14-12-7-4-6-11(13)9-12/h4,6-7,9-10H,2-3,5,8H2,1H3/q-1/p+1/t10-/m0/s1