ditert-butyl 1-phenyl-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: ditert-butyl 1-phenyl-1,2,3-triazole-4,5-dicarboxylate Openeye Name: ditert-butyl 1-phenyltriazole-4,5-dicarboxylate CAS Name: 1-phenyltriazole-4,5-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 1-phenyltriazole-4,5-dicarboxylate Traditional Name: 1-phenyltriazole-4,5-dicarboxylic acid ditert-butyl ester Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(N(N=N1)C2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(N(N=N1)C2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H23N3O4/c1-17(2,3)24-15(22)13-14(16(23)25-18(4,5)6)21(20-19-13)12-10-8-7-9-11-12/h7-11H,1-6H3