3-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]amino]benzoic acid

Systemtic Name: 3-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]amino]benzoic acid Openeye Name: 3-[(4,6-diamino-1,3,5-triazin-2-yl)amino]benzoic acid CAS Name: 3-[(4,6-diamino-1,3,5-triazin-2-yl)amino]benzoic acid IUPAC Name: 3-[(4,6-diamino-1,3,5-triazin-2-yl)amino]benzoic acid Traditional Name: 3-[(4,6-diamino-s-triazin-2-yl)amino]benzoic acid Formula: C10H10N6O2 MolecularWeight: 246.2254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=NC(=N2)N)N)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=NC(=N2)N)N)C(=O)O

InChI

InChI=1S/C10H10N6O2/c11-8-14-9(12)16-10(15-8)13-6-3-1-2-5(4-6)7(17)18/h1-4H,(H,17,18)(H5,11,12,13,14,15,16)