tert-butyl 3,5-diphenyl-1,2,4-triazole-1-carboxylate

Systemtic Name: tert-butyl 3,5-diphenyl-1,2,4-triazole-1-carboxylate Openeye Name: tert-butyl 3,5-diphenyl-1,2,4-triazole-1-carboxylate CAS Name: 3,5-diphenyl-1,2,4-triazole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3,5-diphenyl-1,2,4-triazole-1-carboxylate Traditional Name: 3,5-diphenyl-1,2,4-triazole-1-carboxylic acid tert-butyl ester Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=NC(=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=NC(=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O2/c1-19(2,3)24-18(23)22-17(15-12-8-5-9-13-15)20-16(21-22)14-10-6-4-7-11-14/h4-13H,1-3H3