[4-azanyl-6-[(4-chlorophenyl)amino]-1,3,5-triazin-2-yl]methyl 2-phenoxypyridine-3-carboxylate

Systemtic Name: [4-azanyl-6-[(4-chlorophenyl)amino]-1,3,5-triazin-2-yl]methyl 2-phenoxypyridine-3-carboxylate Openeye Name: [4-amino-6-(4-chloroanilino)-1,3,5-triazin-2-yl]methyl 2-phenoxypyridine-3-carboxylate CAS Name: 2-phenoxy-3-pyridinecarboxylic acid [4-amino-6-(4-chloroanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(4-chloroanilino)-1,3,5-triazin-2-yl]methyl 2-phenoxypyridine-3-carboxylate Traditional Name: 2-phenoxynicotinic acid [4-amino-6-(4-chloroanilino)-s-triazin-2-yl]methyl ester Formula: C22H17ClN6O3 MolecularWeight: 448.86178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)OCC3=NC(=NC(=N3)NC4=CC=C(C=C4)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)OCC3=NC(=NC(=N3)NC4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C22H17ClN6O3/c23-14-8-10-15(11-9-14)26-22-28-18(27-21(24)29-22)13-31-20(30)17-7-4-12-25-19(17)32-16-5-2-1-3-6-16/h1-12H,13H2,(H3,24,26,27,28,29)