[2-[(1S)-1-azaniumylethyl]phenyl]-methylsulfonyl-azanide

Systemtic Name: [2-[(1S)-1-azaniumylethyl]phenyl]-methylsulfonyl-azanide Openeye Name: [2-[(1S)-1-azaniumylethyl]phenyl]-methylsulfonyl-azanide CAS Name: [2-[(1S)-1-ammonioethyl]phenyl]-methylsulfonylazanide IUPAC Name: [2-[(1S)-1-azaniumylethyl]phenyl]-methylsulfonylazanide Traditional Name: [2-[(1S)-1-ammonioethyl]phenyl]-mesyl-azanide Formula: C9H14N2O2S MolecularWeight: 214.28466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1[N-]S(=O)(=O)C)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C9H13N2O2S/c1-7(10)8-5-3-4-6-9(8)11-14(2,12)13/h3-7H,10H2,1-2H3/q-1/p+1/t7-/m0/s1