O3-[2-(2,6-dimethylphenoxy)ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-(2,6-dimethylphenoxy)ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(2,6-dimethylphenoxy)ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(2,6-dimethylphenoxy)ethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-(2,6-dimethylphenoxy)ethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(2,6-dimethylphenoxy)ethyl] ester O1-methyl ester Formula: C19H19NO7 MolecularWeight: 373.35666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19NO7/c1-12-5-4-6-13(2)17(12)26-7-8-27-19(22)15-9-14(18(21)25-3)10-16(11-15)20(23)24/h4-6,9-11H,7-8H2,1-3H3