dimethyl 4-methyl-5-[4-nitro-1,2,3,4-tetrakis(oxidanyl)butyl]pyridazine-3,6-dicarboxylate

Systemtic Name: dimethyl 4-methyl-5-[4-nitro-1,2,3,4-tetrakis(oxidanyl)butyl]pyridazine-3,6-dicarboxylate Openeye Name: dimethyl 4-methyl-5-(1,2,3,4-tetrahydroxy-4-nitro-butyl)pyridazine-3,6-dicarboxylate CAS Name: 4-methyl-5-(1,2,3,4-tetrahydroxy-4-nitrobutyl)pyridazine-3,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-methyl-5-(1,2,3,4-tetrahydroxy-4-nitrobutyl)pyridazine-3,6-dicarboxylate Traditional Name: 4-methyl-5-(1,2,3,4-tetrahydroxy-4-nitro-butyl)pyridazine-3,6-dicarboxylic acid dimethyl ester Formula: C13H17N3O10 MolecularWeight: 375.28818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN=C1C(=O)OC)C(=O)OC)C(C(C(C([N+](=O)[O-])O)O)O)O

Isomeric SMILES

CC1=C(C(=NN=C1C(=O)OC)C(=O)OC)C(C(C(C([N+](=O)[O-])O)O)O)O

InChI

InChI=1S/C13H17N3O10/c1-4-5(8(17)9(18)10(19)11(20)16(23)24)7(13(22)26-3)15-14-6(4)12(21)25-2/h8-11,17-20H,1-3H3