O3-(4-tert-butyl-2-methyl-phenyl) O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-(4-tert-butyl-2-methyl-phenyl) O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-(4-tert-butyl-2-methyl-phenyl) O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-(4-tert-butyl-2-methylphenyl) ester O1-methyl ester IUPAC Name: 3-O-(4-tert-butyl-2-methylphenyl) 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-(4-tert-butyl-2-methyl-phenyl) ester O1-methyl ester Formula: C20H21NO6 MolecularWeight: 371.38384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO6/c1-12-8-15(20(2,3)4)6-7-17(12)27-19(23)14-9-13(18(22)26-5)10-16(11-14)21(24)25/h6-11H,1-5H3