tert-butyl N-(3-phenyl-1,2,4-triazol-4-yl)carbamate

Systemtic Name: tert-butyl N-(3-phenyl-1,2,4-triazol-4-yl)carbamate Openeye Name: tert-butyl N-(3-phenyl-1,2,4-triazol-4-yl)carbamate CAS Name: N-(3-phenyl-1,2,4-triazol-4-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-phenyl-1,2,4-triazol-4-yl)carbamate Traditional Name: N-(3-phenyl-1,2,4-triazol-4-yl)carbamic acid tert-butyl ester Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1C=NN=C1C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NN1C=NN=C1C2=CC=CC=C2

InChI

InChI=1S/C13H16N4O2/c1-13(2,3)19-12(18)16-17-9-14-15-11(17)10-7-5-4-6-8-10/h4-9H,1-3H3,(H,16,18)