(4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-yl)methyl 2-acetyloxybenzoate

Systemtic Name: (4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-yl)methyl 2-acetyloxybenzoate Openeye Name: (4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)methyl 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid (4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)methyl ester IUPAC Name: (4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)methyl 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid (4-methyl-5-oxido-furazan-5-ium-3-yl)methyl ester Formula: C13H12N2O6 MolecularWeight: 292.24418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](ON=C1COC(=O)C2=CC=CC=C2OC(=O)C)[O-]

Isomeric SMILES

CC1=[N+](ON=C1COC(=O)C2=CC=CC=C2OC(=O)C)[O-]

InChI

InChI=1S/C13H12N2O6/c1-8-11(14-21-15(8)18)7-19-13(17)10-5-3-4-6-12(10)20-9(2)16/h3-6H,7H2,1-2H3