dimethyl 5-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(4,6-diamino-1,3,5-triazin-2-yl)benzene-1,3-dicarboxylate CAS Name: 5-(4,6-diamino-1,3,5-triazin-2-yl)benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(4,6-diamino-1,3,5-triazin-2-yl)benzene-1,3-dicarboxylate Traditional Name: 5-(4,6-diamino-s-triazin-2-yl)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C13H13N5O4 MolecularWeight: 303.27342

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C2=NC(=NC(=N2)N)N)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C2=NC(=NC(=N2)N)N)C(=O)OC

InChI

InChI=1S/C13H13N5O4/c1-21-10(19)7-3-6(4-8(5-7)11(20)22-2)9-16-12(14)18-13(15)17-9/h3-5H,1-2H3,(H4,14,15,16,17,18)