1-[1-(4-bromanylphenoxy)-3,3-dimethyl-2-prop-2-enoxy-butyl]-1,2,4-triazole

Systemtic Name: 1-[1-(4-bromanylphenoxy)-3,3-dimethyl-2-prop-2-enoxy-butyl]-1,2,4-triazole Openeye Name: 1-[2-allyloxy-1-(4-bromophenoxy)-3,3-dimethyl-butyl]-1,2,4-triazole CAS Name: 1-[1-(4-bromophenoxy)-3,3-dimethyl-2-prop-2-enoxybutyl]-1,2,4-triazole IUPAC Name: 1-[1-(4-bromophenoxy)-3,3-dimethyl-2-prop-2-enoxybutyl]-1,2,4-triazole Traditional Name: 1-[2-allyloxy-1-(4-bromophenoxy)-3,3-dimethyl-butyl]-1,2,4-triazole Formula: C17H22BrN3O2 MolecularWeight: 380.27948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)Br)OCC=C

Isomeric SMILES

CC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)Br)OCC=C

InChI

InChI=1S/C17H22BrN3O2/c1-5-10-22-15(17(2,3)4)16(21-12-19-11-20-21)23-14-8-6-13(18)7-9-14/h5-9,11-12,15-16H,1,10H2,2-4H3