[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-3-methylsulfonyl-propyl]ammonium CAS Name: [(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-methylsulfonyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-methylsulfonyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-3-mesyl-propyl]ammonium Formula: C13H19N2O5S+ MolecularWeight: 315.36536

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NC1=CC2=C(C=C1)OCCO2)[NH3+]

Isomeric SMILES

CS(=O)(=O)CC[C@@H](C(=O)NC1=CC2=C(C=C1)OCCO2)[NH3+]

InChI

InChI=1S/C13H18N2O5S/c1-21(17,18)7-4-10(14)13(16)15-9-2-3-11-12(8-9)20-6-5-19-11/h2-3,8,10H,4-7,14H2,1H3,(H,15,16)/p+1/t10-/m0/s1