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

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl quinoline-2-carboxylate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C14H12N6O2 MolecularWeight: 296.28408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=NC(=NC(=N3)N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=NC(=NC(=N3)N)N

InChI

InChI=1S/C14H12N6O2/c15-13-18-11(19-14(16)20-13)7-22-12(21)10-6-5-8-3-1-2-4-9(8)17-10/h1-6H,7H2,(H4,15,16,18,19,20)