(5-methyl-1,2-oxazol-3-yl)methyl 2-methyl-6-nitro-benzoate

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 2-methyl-6-nitro-benzoate Openeye Name: (5-methylisoxazol-3-yl)methyl 2-methyl-6-nitro-benzoate CAS Name: 2-methyl-6-nitrobenzoic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 2-methyl-6-nitrobenzoate Traditional Name: 2-methyl-6-nitro-benzoic acid (5-methylisoxazol-3-yl)methyl ester Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OCC2=NOC(=C2)C

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OCC2=NOC(=C2)C

InChI

InChI=1S/C13H12N2O5/c1-8-4-3-5-11(15(17)18)12(8)13(16)19-7-10-6-9(2)20-14-10/h3-6H,7H2,1-2H3