3,4-dimethyl-4-nitro-cyclohexa-2,5-diene-1,2-dicarboxylate

Systemtic Name: 3,4-dimethyl-4-nitro-cyclohexa-2,5-diene-1,2-dicarboxylate Openeye Name: 3,4-dimethyl-4-nitro-cyclohexa-2,5-diene-1,2-dicarboxylate CAS Name: 3,4-dimethyl-4-nitrocyclohexa-2,5-diene-1,2-dicarboxylate IUPAC Name: 3,4-dimethyl-4-nitrocyclohexa-2,5-diene-1,2-dicarboxylate Traditional Name: 3,4-dimethyl-4-nitro-cyclohexa-2,5-diene-1,2-dicarboxylate Formula: C10H9NO6-2 MolecularWeight: 239.18156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C=CC1(C)[N+](=O)[O-])C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C(C=CC1(C)[N+](=O)[O-])C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C10H11NO6/c1-5-7(9(14)15)6(8(12)13)3-4-10(5,2)11(16)17/h3-4,6H,1-2H3,(H,12,13)(H,14,15)/p-2