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

Systemtic Name: 4-[(5-bromanyl-2-chloranyl-phenyl)methyl]-3-methoxy-1H-1,2,4-triazol-5-one Openeye Name: 4-[(5-bromo-2-chloro-phenyl)methyl]-3-methoxy-1H-1,2,4-triazol-5-one CAS Name: 4-[(5-bromo-2-chlorophenyl)methyl]-3-methoxy-1H-1,2,4-triazol-5-one IUPAC Name: 4-[(5-bromo-2-chlorophenyl)methyl]-3-methoxy-1H-1,2,4-triazol-5-one Traditional Name: 4-(5-bromo-2-chloro-benzyl)-3-methoxy-1H-1,2,4-triazol-5-one Formula: C10H9BrClN3O2 MolecularWeight: 318.55436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NNC(=O)N1CC2=C(C=CC(=C2)Br)Cl

Isomeric SMILES

COC1=NNC(=O)N1CC2=C(C=CC(=C2)Br)Cl

InChI

InChI=1S/C10H9BrClN3O2/c1-17-10-14-13-9(16)15(10)5-6-4-7(11)2-3-8(6)12/h2-4H,5H2,1H3,(H,13,16)