dimethyl 4-[1,4-dimethoxy-1,4-bis(oxidanylidene)butan-2-yl]-1-phenyl-indazole-6,7-dicarboxylate

Systemtic Name: dimethyl 4-[1,4-dimethoxy-1,4-bis(oxidanylidene)butan-2-yl]-1-phenyl-indazole-6,7-dicarboxylate Openeye Name: dimethyl 4-(3-methoxy-1-methoxycarbonyl-3-oxo-propyl)-1-phenyl-indazole-6,7-dicarboxylate CAS Name: 4-(1,4-dimethoxy-1,4-dioxobutan-2-yl)-1-phenylindazole-6,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(1,4-dimethoxy-1,4-dioxobutan-2-yl)-1-phenylindazole-6,7-dicarboxylate Traditional Name: 4-(1-carbomethoxy-3-keto-3-methoxy-propyl)-1-phenyl-indazole-6,7-dicarboxylic acid dimethyl ester Formula: C23H22N2O8 MolecularWeight: 454.42938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=C2C=NN(C2=C(C(=C1)C(=O)OC)C(=O)OC)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)CC(C1=C2C=NN(C2=C(C(=C1)C(=O)OC)C(=O)OC)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H22N2O8/c1-30-18(26)11-15(21(27)31-2)14-10-16(22(28)32-3)19(23(29)33-4)20-17(14)12-24-25(20)13-8-6-5-7-9-13/h5-10,12,15H,11H2,1-4H3