azanium 3,3-dimethyl-2H-1,4-benzodioxine-2-carboxylate

Systemtic Name: azanium 3,3-dimethyl-2H-1,4-benzodioxine-2-carboxylate Openeye Name: ammonium 3,3-dimethyl-2H-1,4-benzodioxine-2-carboxylate CAS Name: ammonium 3,3-dimethyl-2H-1,4-benzodioxin-2-carboxylate IUPAC Name: azanium 3,3-dimethyl-2H-1,4-benzodioxine-2-carboxylate Traditional Name: ammonium 3,3-dimethyl-2H-1,4-benzodioxin-2-carboxylate Formula: C11H15NO4 MolecularWeight: 225.2411

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC2=CC=CC=C2O1)C(=O)[O-])C.[NH4+]

Isomeric SMILES

CC1(C(OC2=CC=CC=C2O1)C(=O)[O-])C.[NH4+]

InChI

InChI=1S/C11H12O4.H3N/c1-11(2)9(10(12)13)14-7-5-3-4-6-8(7)15-11;/h3-6,9H,1-2H3,(H,12,13);1H3