diethyl 2,5-dimethyl-1-(4-methyl-3-oxidanylidene-5-phenyl-1H-pyrazol-2-yl)pyrrole-3,4-dicarboxylate

Systemtic Name: diethyl 2,5-dimethyl-1-(4-methyl-3-oxidanylidene-5-phenyl-1H-pyrazol-2-yl)pyrrole-3,4-dicarboxylate Openeye Name: diethyl 2,5-dimethyl-1-(4-methyl-3-oxo-5-phenyl-1H-pyrazol-2-yl)pyrrole-3,4-dicarboxylate CAS Name: 2,5-dimethyl-1-(4-methyl-3-oxo-5-phenyl-1H-pyrazol-2-yl)pyrrole-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2,5-dimethyl-1-(4-methyl-3-oxo-5-phenyl-1H-pyrazol-2-yl)pyrrole-3,4-dicarboxylate Traditional Name: 1-(5-keto-4-methyl-3-phenyl-3-pyrazolin-1-yl)-2,5-dimethyl-pyrrole-3,4-dicarboxylic acid diethyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C(=O)OCC)C)N2C(=O)C(=C(N2)C3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C(=O)OCC)C)N2C(=O)C(=C(N2)C3=CC=CC=C3)C)C

InChI

InChI=1S/C22H25N3O5/c1-6-29-21(27)17-14(4)24(15(5)18(17)22(28)30-7-2)25-20(26)13(3)19(23-25)16-11-9-8-10-12-16/h8-12,23H,6-7H2,1-5H3