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

Systemtic Name: 4-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]benzoic acid Openeye Name: 4-(4,6-diamino-1,3,5-triazin-2-yl)benzoic acid CAS Name: 4-(4,6-diamino-1,3,5-triazin-2-yl)benzoic acid IUPAC Name: 4-(4,6-diamino-1,3,5-triazin-2-yl)benzoic acid Traditional Name: 4-(4,6-diamino-s-triazin-2-yl)benzoic acid Formula: C10H9N5O2 MolecularWeight: 231.21076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NC(=N2)N)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NC(=N2)N)N)C(=O)O

InChI

InChI=1S/C10H9N5O2/c11-9-13-7(14-10(12)15-9)5-1-3-6(4-2-5)8(16)17/h1-4H,(H,16,17)(H4,11,12,13,14,15)