O1-methyl O3-[(3-methyl-1,2-oxazol-5-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[(3-methyl-1,2-oxazol-5-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[(3-methylisoxazol-5-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[(3-methyl-5-isoxazolyl)methyl] ester IUPAC Name: 1-O-methyl 3-O-[(3-methyl-1,2-oxazol-5-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[(3-methylisoxazol-5-yl)methyl] ester Formula: C14H12N2O7 MolecularWeight: 320.25428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O7/c1-8-3-12(23-15-8)7-22-14(18)10-4-9(13(17)21-2)5-11(6-10)16(19)20/h3-6H,7H2,1-2H3