2-methylpropyl 6-nitro-2-oxidanylidene-1,3-benzoxazole-3-carboxylate

Systemtic Name: 2-methylpropyl 6-nitro-2-oxidanylidene-1,3-benzoxazole-3-carboxylate Openeye Name: isobutyl 6-nitro-2-oxo-1,3-benzoxazole-3-carboxylate CAS Name: 6-nitro-2-oxo-1,3-benzoxazole-3-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 6-nitro-2-oxo-1,3-benzoxazole-3-carboxylate Traditional Name: 2-keto-6-nitro-1,3-benzoxazole-3-carboxylic acid isobutyl ester Formula: C12H12N2O6 MolecularWeight: 280.23348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O

Isomeric SMILES

CC(C)COC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C12H12N2O6/c1-7(2)6-19-11(15)13-9-4-3-8(14(17)18)5-10(9)20-12(13)16/h3-5,7H,6H2,1-2H3