5-[(2E)-2-[(4-nitrophenyl)-pyridin-4-yl-methylidene]hydrazinyl]benzene-1,3-dicarboxylate

Systemtic Name: 5-[(2E)-2-[(4-nitrophenyl)-pyridin-4-yl-methylidene]hydrazinyl]benzene-1,3-dicarboxylate Openeye Name: 5-[(2E)-2-[(4-nitrophenyl)-(4-pyridyl)methylene]hydrazino]benzene-1,3-dicarboxylate CAS Name: 5-[(2E)-2-[(4-nitrophenyl)-pyridin-4-ylmethylidene]hydrazinyl]benzene-1,3-dicarboxylate IUPAC Name: 5-[(2E)-2-[(4-nitrophenyl)-pyridin-4-ylmethylidene]hydrazinyl]benzene-1,3-dicarboxylate Traditional Name: 5-[(N'E)-N'-[(4-nitrophenyl)-(4-pyridyl)methylene]hydrazino]isophthalate Formula: C20H12N4O6-2 MolecularWeight: 404.33248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=NNC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-])C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C(=N\NC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-])/C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O6/c25-19(26)14-9-15(20(27)28)11-16(10-14)22-23-18(13-5-7-21-8-6-13)12-1-3-17(4-2-12)24(29)30/h1-11,22H,(H,25,26)(H,27,28)/p-2/b23-18+