2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-cyclopropyl-azanium

Systemtic Name: 2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-cyclopropyl-azanium Openeye Name: 2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-cyclopropyl-ammonium CAS Name: 2-ammonioethyl-(1,3-benzodioxol-5-ylmethyl)-cyclopropylammonium IUPAC Name: 2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-cyclopropylazanium Traditional Name: 2-ammonioethyl-cyclopropyl-piperonyl-ammonium Formula: C13H20N2O2+2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+](CC[NH3+])CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CC1[NH+](CC[NH3+])CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H18N2O2/c14-5-6-15(11-2-3-11)8-10-1-4-12-13(7-10)17-9-16-12/h1,4,7,11H,2-3,5-6,8-9,14H2/p+2