4-(3-cyanophenyl)-1-methyl-4H-pyridine-2,3,5,6-tetracarboxylic acid

Systemtic Name: 4-(3-cyanophenyl)-1-methyl-4H-pyridine-2,3,5,6-tetracarboxylic acid Openeye Name: 4-(3-cyanophenyl)-1-methyl-4H-pyridine-2,3,5,6-tetracarboxylic acid CAS Name: 4-(3-cyanophenyl)-1-methyl-4H-pyridine-2,3,5,6-tetracarboxylic acid IUPAC Name: 4-(3-cyanophenyl)-1-methyl-4H-pyridine-2,3,5,6-tetracarboxylic acid Traditional Name: 4-(3-cyanophenyl)-1-methyl-4H-pyridine-2,3,5,6-tetracarboxylic acid Formula: C17H12N2O8 MolecularWeight: 372.28578

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(C(=C1C(=O)O)C(=O)O)C2=CC=CC(=C2)C#N)C(=O)O)C(=O)O

Isomeric SMILES

CN1C(=C(C(C(=C1C(=O)O)C(=O)O)C2=CC=CC(=C2)C#N)C(=O)O)C(=O)O

InChI

InChI=1S/C17H12N2O8/c1-19-12(16(24)25)10(14(20)21)9(8-4-2-3-7(5-8)6-18)11(15(22)23)13(19)17(26)27/h2-5,9H,1H3,(H,20,21)(H,22,23)(H,24,25)(H,26,27)