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

Systemtic Name: 4-[(5-bromanyl-2-methyl-phenyl)methyl]-3-(hydroxymethyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-[(5-bromo-2-methyl-phenyl)methyl]-3-(hydroxymethyl)-1H-1,2,4-triazol-5-one CAS Name: 4-[(5-bromo-2-methylphenyl)methyl]-3-(hydroxymethyl)-1H-1,2,4-triazol-5-one IUPAC Name: 4-[(5-bromo-2-methylphenyl)methyl]-3-(hydroxymethyl)-1H-1,2,4-triazol-5-one Traditional Name: 4-(5-bromo-2-methyl-benzyl)-3-methylol-1H-1,2,4-triazol-5-one Formula: C11H12BrN3O2 MolecularWeight: 298.13588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)CN2C(=NNC2=O)CO

Isomeric SMILES

CC1=C(C=C(C=C1)Br)CN2C(=NNC2=O)CO

InChI

InChI=1S/C11H12BrN3O2/c1-7-2-3-9(12)4-8(7)5-15-10(6-16)13-14-11(15)17/h2-4,16H,5-6H2,1H3,(H,14,17)