2-[methyl-[2-(2-oxidanidyl-1,3-benzoxazol-6-yl)-2-oxidanylidene-ethyl]azaniumyl]ethanoate

Systemtic Name: 2-[methyl-[2-(2-oxidanidyl-1,3-benzoxazol-6-yl)-2-oxidanylidene-ethyl]azaniumyl]ethanoate Openeye Name: 2-[methyl-[2-(2-oxido-1,3-benzoxazol-6-yl)-2-oxo-ethyl]ammonio]acetate CAS Name: 2-[methyl-[2-(2-oxido-1,3-benzoxazol-6-yl)-2-oxoethyl]ammonio]acetate IUPAC Name: 2-[methyl-[2-(2-oxido-1,3-benzoxazol-6-yl)-2-oxoethyl]azaniumyl]acetate Traditional Name: 2-[[2-keto-2-(2-oxido-1,3-benzoxazol-6-yl)ethyl]-methyl-ammonio]acetate Formula: C12H11N2O5- MolecularWeight: 263.22614

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)C1=CC2=C(C=C1)N=C(O2)[O-])CC(=O)[O-]

Isomeric SMILES

C[NH+](CC(=O)C1=CC2=C(C=C1)N=C(O2)[O-])CC(=O)[O-]

InChI

InChI=1S/C12H12N2O5/c1-14(6-11(16)17)5-9(15)7-2-3-8-10(4-7)19-12(18)13-8/h2-4H,5-6H2,1H3,(H,13,18)(H,16,17)/p-1