(2,4-dimethylphenyl)methyl 4-azanyl-1,2,5-oxadiazole-3-carboxylate

Systemtic Name: (2,4-dimethylphenyl)methyl 4-azanyl-1,2,5-oxadiazole-3-carboxylate Openeye Name: (2,4-dimethylphenyl)methyl 4-amino-1,2,5-oxadiazole-3-carboxylate CAS Name: 4-amino-1,2,5-oxadiazole-3-carboxylic acid (2,4-dimethylphenyl)methyl ester IUPAC Name: (2,4-dimethylphenyl)methyl 4-amino-1,2,5-oxadiazole-3-carboxylate Traditional Name: 4-aminofurazan-3-carboxylic acid (2,4-dimethylbenzyl) ester Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)COC(=O)C2=NON=C2N)C

Isomeric SMILES

CC1=CC(=C(C=C1)COC(=O)C2=NON=C2N)C

InChI

InChI=1S/C12H13N3O3/c1-7-3-4-9(8(2)5-7)6-17-12(16)10-11(13)15-18-14-10/h3-5H,6H2,1-2H3,(H2,13,15)