O1-methyl O3-(4-methylphenyl) 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-(4-methylphenyl) 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-(p-tolyl) 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-(4-methylphenyl) ester IUPAC Name: 1-O-methyl 3-O-(4-methylphenyl) 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-(p-tolyl) ester Formula: C16H13NO6 MolecularWeight: 315.27752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO6/c1-10-3-5-14(6-4-10)23-16(19)12-7-11(15(18)22-2)8-13(9-12)17(20)21/h3-9H,1-2H3