5-[2,5-dimethyl-3-[(Z)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]pyrrol-1-yl]benzene-1,3-dicarboxylate

Systemtic Name: 5-[2,5-dimethyl-3-[(Z)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]pyrrol-1-yl]benzene-1,3-dicarboxylate Openeye Name: 5-[2,5-dimethyl-3-[(Z)-(pyridine-3-carbonylhydrazono)methyl]pyrrol-1-yl]benzene-1,3-dicarboxylate CAS Name: 5-[2,5-dimethyl-3-[(Z)-[[oxo(3-pyridinyl)methyl]hydrazinylidene]methyl]-1-pyrrolyl]benzene-1,3-dicarboxylate IUPAC Name: 5-[2,5-dimethyl-3-[(Z)-(pyridine-3-carbonylhydrazinylidene)methyl]pyrrol-1-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[2,5-dimethyl-3-[(Z)-(nicotinoylhydrazono)methyl]pyrrol-1-yl]isophthalate Formula: C21H16N4O5-2 MolecularWeight: 404.37554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-])C)C=NNC(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-])C)/C=N\NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H18N4O5/c1-12-6-17(11-23-24-19(26)14-4-3-5-22-10-14)13(2)25(12)18-8-15(20(27)28)7-16(9-18)21(29)30/h3-11H,1-2H3,(H,24,26)(H,27,28)(H,29,30)/p-2/b23-11-