dimethylazanium; (1R,4S)-2-(dimethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylate

Systemtic Name: dimethylazanium; (1R,4S)-2-(dimethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylate Openeye Name: dimethylammonium; (1R,4S)-2-(dimethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylate CAS Name: (1R,4S)-2-[dimethylamino(oxo)methyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylate; dimethylammonium IUPAC Name: dimethylazanium; (1R,4S)-2-(dimethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylate Traditional Name: dimethylammonium; (1R,4S)-2-(dimethylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylate Formula: C12H20N2O4 MolecularWeight: 256.2982

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]C.CN(C)C(=O)C1C2C=CC(C1C(=O)[O-])O2

Isomeric SMILES

C[NH2+]C.CN(C)C(=O)C1[C@H]2C=C[C@@H](C1C(=O)[O-])O2

InChI

InChI=1S/C10H13NO4.C2H7N/c1-11(2)9(12)7-5-3-4-6(15-5)8(7)10(13)14;1-3-2/h3-8H,1-2H3,(H,13,14);3H,1-2H3/t5-,6+,7?,8?;/m1./s1