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

Systemtic Name: [(2S)-2-(azaniumylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethyl-azanium Openeye Name: [(2S)-2-(azaniumylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethyl-ammonium CAS Name: [(2S)-2-(ammoniomethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethylammonium IUPAC Name: [(2S)-2-(azaniumylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethylazanium Traditional Name: [(2S)-2-(ammoniomethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]-dimethyl-ammonium Formula: C14H24N2O2+2 MolecularWeight: 252.35256

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(CC1=CC2=C(C=C1)OCCO2)C[NH3+]

Isomeric SMILES

C[NH+](C)C[C@@H](CC1=CC2=C(C=C1)OCCO2)C[NH3+]

InChI

InChI=1S/C14H22N2O2/c1-16(2)10-12(9-15)7-11-3-4-13-14(8-11)18-6-5-17-13/h3-4,8,12H,5-7,9-10,15H2,1-2H3/p+2/t12-/m0/s1