tert-butyl N-[3-[(4-chlorophenyl)methyl]-1,2,4-triazol-4-yl]carbamate

Systemtic Name: tert-butyl N-[3-[(4-chlorophenyl)methyl]-1,2,4-triazol-4-yl]carbamate Openeye Name: tert-butyl N-[3-[(4-chlorophenyl)methyl]-1,2,4-triazol-4-yl]carbamate CAS Name: N-[3-[(4-chlorophenyl)methyl]-1,2,4-triazol-4-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[(4-chlorophenyl)methyl]-1,2,4-triazol-4-yl]carbamate Traditional Name: N-[3-(4-chlorobenzyl)-1,2,4-triazol-4-yl]carbamic acid tert-butyl ester Formula: C14H17ClN4O2 MolecularWeight: 308.76338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1C=NN=C1CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NN1C=NN=C1CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H17ClN4O2/c1-14(2,3)21-13(20)18-19-9-16-17-12(19)8-10-4-6-11(15)7-5-10/h4-7,9H,8H2,1-3H3,(H,18,20)