[2-[(1S)-1-azaniumylethyl]phenyl]-piperidin-1-ium-1-ylsulfonyl-azanide

Systemtic Name: [2-[(1S)-1-azaniumylethyl]phenyl]-piperidin-1-ium-1-ylsulfonyl-azanide Openeye Name: [2-[(1S)-1-azaniumylethyl]phenyl]-piperidin-1-ium-1-ylsulfonyl-azanide CAS Name: [2-[(1S)-1-ammonioethyl]phenyl]-(1-piperidin-1-iumylsulfonyl)azanide IUPAC Name: [2-[(1S)-1-azaniumylethyl]phenyl]-piperidin-1-ium-1-ylsulfonylazanide Traditional Name: [2-[(1S)-1-ammonioethyl]phenyl]-piperidin-1-ium-1-ylsulfonyl-azanide Formula: C13H22N3O2S+ MolecularWeight: 284.39768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1[N-]S(=O)(=O)[NH+]2CCCCC2)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1[N-]S(=O)(=O)[NH+]2CCCCC2)[NH3+]

InChI

InChI=1S/C13H20N3O2S/c1-11(14)12-7-3-4-8-13(12)15-19(17,18)16-9-5-2-6-10-16/h3-4,7-8,11H,2,5-6,9-10,14H2,1H3/q-1/p+2/t11-/m0/s1