O2-[(4,5-dimethoxy-2-nitro-phenyl)methyl] O1-methyl (1S,2R)-cyclohexane-1,2-dicarboxylate

Systemtic Name: O2-[(4,5-dimethoxy-2-nitro-phenyl)methyl] O1-methyl (1S,2R)-cyclohexane-1,2-dicarboxylate Openeye Name: O2-[(4,5-dimethoxy-2-nitro-phenyl)methyl] O1-methyl (1S,2R)-cyclohexane-1,2-dicarboxylate CAS Name: (1S,2R)-cyclohexane-1,2-dicarboxylic acid O2-[(4,5-dimethoxy-2-nitrophenyl)methyl] ester O1-methyl ester IUPAC Name: 2-O-[(4,5-dimethoxy-2-nitrophenyl)methyl] 1-O-methyl (1S,2R)-cyclohexane-1,2-dicarboxylate Traditional Name: (1S,2R)-cyclohexane-1,2-dicarboxylic acid O2-(4,5-dimethoxy-2-nitro-benzyl) ester O1-methyl ester Formula: C18H23NO8 MolecularWeight: 381.37712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)C2CCCCC2C(=O)OC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)[C@@H]2CCCC[C@@H]2C(=O)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C18H23NO8/c1-24-15-8-11(14(19(22)23)9-16(15)25-2)10-27-18(21)13-7-5-4-6-12(13)17(20)26-3/h8-9,12-13H,4-7,10H2,1-3H3/t12-,13+/m0/s1