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

Systemtic Name: 4-[[2,4,6-tris(azanyl)pyrimidin-5-yl]diazenyl]benzoic acid Openeye Name: 4-(2,4,6-triaminopyrimidin-5-yl)azobenzoic acid CAS Name: 4-[(2,4,6-triamino-5-pyrimidinyl)azo]benzoic acid IUPAC Name: 4-[(2,4,6-triaminopyrimidin-5-yl)diazenyl]benzoic acid Traditional Name: 4-(2,4,6-triaminopyrimidin-5-yl)azobenzoic acid Formula: C11H11N7O2 MolecularWeight: 273.25074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N=NC2=C(N=C(N=C2N)N)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N=NC2=C(N=C(N=C2N)N)N

InChI

InChI=1S/C11H11N7O2/c12-8-7(9(13)16-11(14)15-8)18-17-6-3-1-5(2-4-6)10(19)20/h1-4H,(H,19,20)(H6,12,13,14,15,16)