3-[[3-(3-bromanylphenoxy)-4-chloranyl-phenyl]methyl]-4-ethyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[[3-(3-bromanylphenoxy)-4-chloranyl-phenyl]methyl]-4-ethyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[[3-(3-bromophenoxy)-4-chloro-phenyl]methyl]-4-ethyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[3-(3-bromophenoxy)-4-chlorophenyl]methyl]-4-ethyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[[3-(3-bromophenoxy)-4-chlorophenyl]methyl]-4-ethyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[3-(3-bromophenoxy)-4-chloro-benzyl]-4-ethyl-1H-1,2,4-triazol-5-one Formula: C17H15BrClN3O2 MolecularWeight: 408.6769

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=O)CC2=CC(=C(C=C2)Cl)OC3=CC(=CC=C3)Br

Isomeric SMILES

CCN1C(=NNC1=O)CC2=CC(=C(C=C2)Cl)OC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H15BrClN3O2/c1-2-22-16(20-21-17(22)23)9-11-6-7-14(19)15(8-11)24-13-5-3-4-12(18)10-13/h3-8,10H,2,9H2,1H3,(H,21,23)