N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine; methanesulfonic acid

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine; methanesulfonic acid Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine; methanesulfonic acid CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-propanamine; methanesulfonic acid IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine; methanesulfonic acid Traditional Name: isopropyl(piperonyl)amine; mesylic acid Formula: C12H19NO5S MolecularWeight: 289.34796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC1=CC2=C(C=C1)OCO2.CS(=O)(=O)O

Isomeric SMILES

CC(C)NCC1=CC2=C(C=C1)OCO2.CS(=O)(=O)O

InChI

InChI=1S/C11H15NO2.CH4O3S/c1-8(2)12-6-9-3-4-10-11(5-9)14-7-13-10;1-5(2,3)4/h3-5,8,12H,6-7H2,1-2H3;1H3,(H,2,3,4)