2-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]azaniumyl]ethyl-methylsulfonyl-azanide

Systemtic Name: 2-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]azaniumyl]ethyl-methylsulfonyl-azanide Openeye Name: 2-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]ammonio]ethyl-methylsulfonyl-azanide CAS Name: 2-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]ammonio]ethyl-methylsulfonylazanide IUPAC Name: 2-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]azaniumyl]ethyl-methylsulfonylazanide Traditional Name: 2-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]ammonio]ethyl-mesyl-azanide Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)[NH2+]CC[N-]S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCO2)[NH2+]CC[N-]S(=O)(=O)C

InChI

InChI=1S/C12H17N2O4S/c1-9(13-5-6-14-19(2,15)16)10-3-4-11-12(7-10)18-8-17-11/h3-4,7,9,13H,5-6,8H2,1-2H3/q-1/p+1/t9-/m0/s1