2-oxidanyl-4-[[2,4,6-tris(azanyl)pyrimidin-5-yl]diazenyl]benzoic acid

Systemtic Name: 2-oxidanyl-4-[[2,4,6-tris(azanyl)pyrimidin-5-yl]diazenyl]benzoic acid Openeye Name: 2-hydroxy-4-(2,4,6-triaminopyrimidin-5-yl)azo-benzoic acid CAS Name: 2-hydroxy-4-[(2,4,6-triamino-5-pyrimidinyl)azo]benzoic acid IUPAC Name: 2-hydroxy-4-[(2,4,6-triaminopyrimidin-5-yl)diazenyl]benzoic acid Traditional Name: 2-hydroxy-4-(2,4,6-triaminopyrimidin-5-yl)azo-benzoic acid Formula: C11H11N7O3 MolecularWeight: 289.25014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=NC2=C(N=C(N=C2N)N)N)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N=NC2=C(N=C(N=C2N)N)N)O)C(=O)O

InChI

InChI=1S/C11H11N7O3/c12-8-7(9(13)16-11(14)15-8)18-17-4-1-2-5(10(20)21)6(19)3-4/h1-3,19H,(H,20,21)(H6,12,13,14,15,16)