[(3S)-3-azaniumyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethyl-azanium

Systemtic Name: [(3S)-3-azaniumyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethyl-azanium Openeye Name: [(3S)-3-azaniumyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethyl-ammonium CAS Name: [(3S)-3-ammonio-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethylammonium IUPAC Name: [(3S)-3-azaniumyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethylazanium Traditional Name: [(3S)-3-ammonio-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethyl-ammonium Formula: C13H22N2O2+2 MolecularWeight: 238.32598

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC(C1=CC2=C(C=C1)OCCO2)[NH3+]

Isomeric SMILES

C[NH+](C)CC[C@@H](C1=CC2=C(C=C1)OCCO2)[NH3+]

InChI

InChI=1S/C13H20N2O2/c1-15(2)6-5-11(14)10-3-4-12-13(9-10)17-8-7-16-12/h3-4,9,11H,5-8,14H2,1-2H3/p+2/t11-/m0/s1