(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl) anthracene-9-carboxylate

Systemtic Name: (5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl) anthracene-9-carboxylate Openeye Name: (5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl) anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid (5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl) ester IUPAC Name: (5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl) anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid (5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl) ester Formula: C21H14N4O2 MolecularWeight: 354.36146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NC=NN2C(=C1)OC(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53

Isomeric SMILES

CC1=NC2=NC=NN2C(=C1)OC(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53

InChI

InChI=1S/C21H14N4O2/c1-13-10-18(25-21(24-13)22-12-23-25)27-20(26)19-16-8-4-2-6-14(16)11-15-7-3-5-9-17(15)19/h2-12H,1H3