[(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-1-(4-ethoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-1-(4-ethoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-1-(4-ethoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-1-(4-ethoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-1-(4-ethoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-1-p-phenetyl-ethyl]-dimethyl-ammonium Formula: C20H27N2O5S+ MolecularWeight: 407.50378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC3=C(C=C2)OCCO3)[NH+](C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H](CNS(=O)(=O)C2=CC3=C(C=C2)OCCO3)[NH+](C)C

InChI

InChI=1S/C20H26N2O5S/c1-4-25-16-7-5-15(6-8-16)18(22(2)3)14-21-28(23,24)17-9-10-19-20(13-17)27-12-11-26-19/h5-10,13,18,21H,4,11-12,14H2,1-3H3/p+1/t18-/m0/s1