2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate CAS Name: 1,5-diphenyl-1,2,4-triazole-3-carboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate Traditional Name: 1,5-diphenyl-1,2,4-triazole-3-carboxylic acid 2-phthalimidoethyl ester Formula: C25H18N4O4 MolecularWeight: 438.43482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)OCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)OCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H18N4O4/c30-23-19-13-7-8-14-20(19)24(31)28(23)15-16-33-25(32)21-26-22(17-9-3-1-4-10-17)29(27-21)18-11-5-2-6-12-18/h1-14H,15-16H2