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

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 2-phenylquinoline-4-carboxylate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-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 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C20H16N6O2 MolecularWeight: 372.38004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=NC(=NC(=N4)N)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=NC(=NC(=N4)N)N

InChI

InChI=1S/C20H16N6O2/c21-19-24-17(25-20(22)26-19)11-28-18(27)14-10-16(12-6-2-1-3-7-12)23-15-9-5-4-8-13(14)15/h1-10H,11H2,(H4,21,22,24,25,26)