2,4-bis(2-methoxyethyl)-5-nitro-benzene-1,3-dicarboxylate

Systemtic Name: 2,4-bis(2-methoxyethyl)-5-nitro-benzene-1,3-dicarboxylate Openeye Name: 2,4-bis(2-methoxyethyl)-5-nitro-benzene-1,3-dicarboxylate CAS Name: 2,4-bis(2-methoxyethyl)-5-nitrobenzene-1,3-dicarboxylate IUPAC Name: 2,4-bis(2-methoxyethyl)-5-nitrobenzene-1,3-dicarboxylate Traditional Name: 2,4-bis(2-methoxyethyl)-5-nitro-isophthalate Formula: C14H15NO8-2 MolecularWeight: 325.2708

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Descriptors Computed from Structure

Canonical SMILES:

COCCC1=C(C(=C(C=C1C(=O)[O-])[N+](=O)[O-])CCOC)C(=O)[O-]

Isomeric SMILES

COCCC1=C(C(=C(C=C1C(=O)[O-])[N+](=O)[O-])CCOC)C(=O)[O-]

InChI

InChI=1S/C14H17NO8/c1-22-5-3-8-10(13(16)17)7-11(15(20)21)9(4-6-23-2)12(8)14(18)19/h7H,3-6H2,1-2H3,(H,16,17)(H,18,19)/p-2