2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-[[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: 2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-[[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: 2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: 2-ammonioethyl-(1,3-benzodioxol-5-ylmethyl)-[[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: 2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-[[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: 2-ammonioethyl-piperonyl-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C15H24N2O3+2 MolecularWeight: 280.36266

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C[NH+](CC[NH3+])CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1C[C@@H](OC1)C[NH+](CC[NH3+])CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H22N2O3/c16-5-6-17(10-13-2-1-7-18-13)9-12-3-4-14-15(8-12)20-11-19-14/h3-4,8,13H,1-2,5-7,9-11,16H2/p+2/t13-/m1/s1