6-oxidanylidene-1-[2-(pyridin-4-ylcarbonylamino)ethyl]pyridine-3-carboxylic acid

Systemtic Name: 6-oxidanylidene-1-[2-(pyridin-4-ylcarbonylamino)ethyl]pyridine-3-carboxylic acid Openeye Name: 6-oxo-1-[2-(pyridine-4-carbonylamino)ethyl]pyridine-3-carboxylic acid CAS Name: 6-oxo-1-[2-[[oxo(pyridin-4-yl)methyl]amino]ethyl]-3-pyridinecarboxylic acid IUPAC Name: 6-oxo-1-[2-(pyridine-4-carbonylamino)ethyl]pyridine-3-carboxylic acid Traditional Name: 1-(2-isonicotinamidoethyl)-6-keto-nicotinic acid Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)N(C=C1C(=O)O)CCNC(=O)C2=CC=NC=C2

Isomeric SMILES

C1=CC(=O)N(C=C1C(=O)O)CCNC(=O)C2=CC=NC=C2

InChI

InChI=1S/C14H13N3O4/c18-12-2-1-11(14(20)21)9-17(12)8-7-16-13(19)10-3-5-15-6-4-10/h1-6,9H,7-8H2,(H,16,19)(H,20,21)