[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 5-chloranyl-1-benzofuran-2-carboxylate

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 5-chloranyl-1-benzofuran-2-carboxylate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 5-chlorobenzofuran-2-carboxylate CAS Name: 5-chloro-2-benzofurancarboxylic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 5-chloro-1-benzofuran-2-carboxylate Traditional Name: 5-chlorocoumarilic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C13H10ClN5O3 MolecularWeight: 319.7032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C=C(O2)C(=O)OCC3=NC(=NC(=N3)N)N

Isomeric SMILES

C1=CC2=C(C=C1Cl)C=C(O2)C(=O)OCC3=NC(=NC(=N3)N)N

InChI

InChI=1S/C13H10ClN5O3/c14-7-1-2-8-6(3-7)4-9(22-8)11(20)21-5-10-17-12(15)19-13(16)18-10/h1-4H,5H2,(H4,15,16,17,18,19)