(2Z,6Z)-2,7-bis(pyridin-2-ylcarbonylamino)octa-2,6-dienedioic acid

Systemtic Name: (2Z,6Z)-2,7-bis(pyridin-2-ylcarbonylamino)octa-2,6-dienedioic acid Openeye Name: (2Z,6Z)-2,7-bis(pyridine-2-carbonylamino)octa-2,6-dienedioic acid CAS Name: (2Z,6Z)-2,7-bis[[oxo(2-pyridinyl)methyl]amino]octa-2,6-dienedioic acid IUPAC Name: (2Z,6Z)-2,7-bis(pyridine-2-carbonylamino)octa-2,6-dienedioic acid Traditional Name: (2Z,6Z)-2,7-dipicolinamidoocta-2,6-dienedioic acid Formula: C20H18N4O6 MolecularWeight: 410.38012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=O)NC(=CCCC=C(C(=O)O)NC(=O)C2=CC=CC=N2)C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)C(=O)N/C(=C\CC/C=C(\NC(=O)C2=CC=CC=N2)/C(=O)O)/C(=O)O

InChI

InChI=1S/C20H18N4O6/c25-17(13-7-3-5-11-21-13)23-15(19(27)28)9-1-2-10-16(20(29)30)24-18(26)14-8-4-6-12-22-14/h3-12H,1-2H2,(H,23,25)(H,24,26)(H,27,28)(H,29,30)/b15-9-,16-10-