[4-(1,3-benzodioxol-5-yl)butan-2-ylamino]azanium chloride

Systemtic Name: [4-(1,3-benzodioxol-5-yl)butan-2-ylamino]azanium chloride Openeye Name: [[3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]amino]ammonium chloride CAS Name: [4-(1,3-benzodioxol-5-yl)butan-2-ylamino]ammonium chloride IUPAC Name: [4-(1,3-benzodioxol-5-yl)butan-2-ylamino]azanium chloride Traditional Name: [[3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]amino]ammonium chloride Formula: C11H17ClN2O2 MolecularWeight: 244.71788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)N[NH3+].[Cl-]

Isomeric SMILES

CC(CCC1=CC2=C(C=C1)OCO2)N[NH3+].[Cl-]

InChI

InChI=1S/C11H16N2O2.ClH/c1-8(13-12)2-3-9-4-5-10-11(6-9)15-7-14-10;/h4-6,8,13H,2-3,7,12H2,1H3;1H