[3-[1,3-benzodioxol-5-yl(ethyl)amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[1,3-benzodioxol-5-yl(ethyl)amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[1,3-benzodioxol-5-yl(ethyl)amino]-3-oxo-propyl]ammonium CAS Name: [3-[1,3-benzodioxol-5-yl(ethyl)amino]-3-oxopropyl]ammonium IUPAC Name: [3-[1,3-benzodioxol-5-yl(ethyl)amino]-3-oxopropyl]azanium Traditional Name: [3-[1,3-benzodioxol-5-yl(ethyl)amino]-3-keto-propyl]ammonium Formula: C12H17N2O3+ MolecularWeight: 237.27498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3/c1-2-14(12(15)5-6-13)9-3-4-10-11(7-9)17-8-16-10/h3-4,7H,2,5-6,8,13H2,1H3/p+1