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

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 6-methoxy-2-phenyl-quinoline-4-carboxylate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 6-methoxy-2-phenyl-quinoline-4-carboxylate CAS Name: 6-methoxy-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 6-methoxy-2-phenylquinoline-4-carboxylate Traditional Name: 6-methoxy-2-phenyl-cinchoninic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C21H18N6O3 MolecularWeight: 402.40602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC3=NC(=NC(=N3)N)N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC3=NC(=NC(=N3)N)N)C4=CC=CC=C4

InChI

InChI=1S/C21H18N6O3/c1-29-13-7-8-16-14(9-13)15(10-17(24-16)12-5-3-2-4-6-12)19(28)30-11-18-25-20(22)27-21(23)26-18/h2-10H,11H2,1H3,(H4,22,23,25,26,27)