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

Systemtic Name: 2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-(2-methoxyethyl)azanium Openeye Name: 2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-(2-methoxyethyl)ammonium CAS Name: 2-ammonioethyl-(1,3-benzodioxol-5-ylmethyl)-(2-methoxyethyl)ammonium IUPAC Name: 2-azaniumylethyl-(1,3-benzodioxol-5-ylmethyl)-(2-methoxyethyl)azanium Traditional Name: 2-ammonioethyl-(2-methoxyethyl)-piperonyl-ammonium Formula: C13H22N2O3+2 MolecularWeight: 254.32538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O3/c1-16-7-6-15(5-4-14)9-11-2-3-12-13(8-11)18-10-17-12/h2-3,8H,4-7,9-10,14H2,1H3/p+2