O3-[(2-methoxy-5-methyl-phenyl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[(2-methoxy-5-methyl-phenyl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[(2-methoxy-5-methyl-phenyl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(2-methoxy-5-methylphenyl)methyl] ester O1-methyl ester IUPAC Name: 3-O-[(2-methoxy-5-methylphenyl)methyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-(2-methoxy-5-methyl-benzyl) ester O1-methyl ester Formula: C18H17NO7 MolecularWeight: 359.33008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO7/c1-11-4-5-16(24-2)14(6-11)10-26-18(21)13-7-12(17(20)25-3)8-15(9-13)19(22)23/h4-9H,10H2,1-3H3