[2-[1,3-benzodioxol-5-ylmethyl(prop-2-enyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[1,3-benzodioxol-5-ylmethyl(prop-2-enyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[allyl(1,3-benzodioxol-5-ylmethyl)amino]-2-oxo-ethyl]ammonium CAS Name: [2-[1,3-benzodioxol-5-ylmethyl(prop-2-enyl)amino]-2-oxoethyl]ammonium IUPAC Name: [2-[1,3-benzodioxol-5-ylmethyl(prop-2-enyl)amino]-2-oxoethyl]azanium Traditional Name: [2-[allyl(piperonyl)amino]-2-keto-ethyl]ammonium Formula: C13H17N2O3+ MolecularWeight: 249.28568

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C[NH3+]

Isomeric SMILES

C=CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C[NH3+]

InChI

InChI=1S/C13H16N2O3/c1-2-5-15(13(16)7-14)8-10-3-4-11-12(6-10)18-9-17-11/h2-4,6H,1,5,7-9,14H2/p+1