[(2S)-3-(1,3-benzodioxol-5-yl)-2-methyl-propyl]azanium

Systemtic Name: [(2S)-3-(1,3-benzodioxol-5-yl)-2-methyl-propyl]azanium Openeye Name: [(2S)-3-(1,3-benzodioxol-5-yl)-2-methyl-propyl]ammonium CAS Name: [(2S)-3-(1,3-benzodioxol-5-yl)-2-methylpropyl]ammonium IUPAC Name: [(2S)-3-(1,3-benzodioxol-5-yl)-2-methylpropyl]azanium Traditional Name: [(2S)-3-(1,3-benzodioxol-5-yl)-2-methyl-propyl]ammonium Formula: C11H16NO2+ MolecularWeight: 194.25024

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=C(C=C1)OCO2)C[NH3+]

Isomeric SMILES

C[C@@H](CC1=CC2=C(C=C1)OCO2)C[NH3+]

InChI

InChI=1S/C11H15NO2/c1-8(6-12)4-9-2-3-10-11(5-9)14-7-13-10/h2-3,5,8H,4,6-7,12H2,1H3/p+1/t8-/m0/s1