O4-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl] O1-methyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl] O1-methyl benzene-1,4-dicarboxylate Openeye Name: O4-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl] ester O1-methyl ester IUPAC Name: 4-O-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl] 1-O-methyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[(4-amino-6-anilino-s-triazin-2-yl)methyl] ester O1-methyl ester Formula: C19H17N5O4 MolecularWeight: 379.36938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C19H17N5O4/c1-27-16(25)12-7-9-13(10-8-12)17(26)28-11-15-22-18(20)24-19(23-15)21-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H3,20,21,22,23,24)