2-[[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]azaniumyl]ethyl-methylsulfonyl-azanide

Systemtic Name: 2-[[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]azaniumyl]ethyl-methylsulfonyl-azanide Openeye Name: 2-[[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]ammonio]ethyl-methylsulfonyl-azanide CAS Name: 2-[[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]ammonio]ethyl-methylsulfonylazanide IUPAC Name: 2-[[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]azaniumyl]ethyl-methylsulfonylazanide Traditional Name: 2-[[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]ammonio]ethyl-mesyl-azanide Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)[NH2+]CC[N-]S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCCO2)[NH2+]CC[N-]S(=O)(=O)C

InChI

InChI=1S/C13H19N2O4S/c1-10(14-5-6-15-20(2,16)17)11-3-4-12-13(9-11)19-8-7-18-12/h3-4,9-10,14H,5-8H2,1-2H3/q-1/p+1/t10-/m0/s1