2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(2-methoxy-2-oxidanylidene-ethyl)azanium

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(2-methoxy-2-oxidanylidene-ethyl)azanium Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(2-methoxy-2-oxo-ethyl)ammonium CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(2-methoxy-2-oxoethyl)ammonium IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(2-methoxy-2-oxoethyl)azanium Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(2-keto-2-methoxy-ethyl)ammonium Formula: C13H18NO4+ MolecularWeight: 252.28632

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C[NH2+]CCC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

COC(=O)C[NH2+]CCC1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C13H17NO4/c1-16-13(15)9-14-5-4-10-2-3-11-12(8-10)18-7-6-17-11/h2-3,8,14H,4-7,9H2,1H3/p+1