3-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]pyridine-4-carboxylic acid

Systemtic Name: 3-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]pyridine-4-carboxylic acid Openeye Name: 3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]pyridine-4-carboxylic acid CAS Name: 3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-4-pyridinecarboxylic acid IUPAC Name: 3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]pyridine-4-carboxylic acid Traditional Name: 3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]isonicotinic acid Formula: C14H12N4O4 MolecularWeight: 300.26948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C(NC2=C(C=CN=C2)C(=O)O)N=O)NO

Isomeric SMILES

C1=CC=C(C=C1)/C(=C(/NC2=C(C=CN=C2)C(=O)O)\N=O)/NO

InChI

InChI=1S/C14H12N4O4/c19-14(20)10-6-7-15-8-11(10)16-13(18-22)12(17-21)9-4-2-1-3-5-9/h1-8,16-17,21H,(H,19,20)/b13-12+