[(1S,2S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-butyl]azanium

Systemtic Name: [(1S,2S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-butyl]azanium Openeye Name: [(1S,2S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-butyl]ammonium CAS Name: [(1S,2S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylbutyl]ammonium IUPAC Name: [(1S,2S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylbutyl]azanium Traditional Name: [(1S,2S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-butyl]ammonium Formula: C13H20NO2+ MolecularWeight: 222.3034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO2/c1-3-9(2)13(14)10-4-5-11-12(8-10)16-7-6-15-11/h4-5,8-9,13H,3,6-7,14H2,1-2H3/p+1/t9-,13-/m0/s1