O4-tert-butyl O1-methyl 2-nitrobenzene-1,4-dicarboxylate

Systemtic Name: O4-tert-butyl O1-methyl 2-nitrobenzene-1,4-dicarboxylate Openeye Name: O4-tert-butyl O1-methyl 2-nitrobenzene-1,4-dicarboxylate CAS Name: 2-nitrobenzene-1,4-dicarboxylic acid O4-tert-butyl ester O1-methyl ester IUPAC Name: 4-O-tert-butyl 1-O-methyl 2-nitrobenzene-1,4-dicarboxylate Traditional Name: 2-nitrobenzene-1,4-dicarboxylic acid O4-tert-butyl ester O1-methyl ester Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H15NO6/c1-13(2,3)20-11(15)8-5-6-9(12(16)19-4)10(7-8)14(17)18/h5-7H,1-4H3