1-bromanyl-3-methyl-1-(1,2,4-triazol-1-yl)butan-2-one

Systemtic Name: 1-bromanyl-3-methyl-1-(1,2,4-triazol-1-yl)butan-2-one Openeye Name: 1-bromo-3-methyl-1-(1,2,4-triazol-1-yl)butan-2-one CAS Name: 1-bromo-3-methyl-1-(1,2,4-triazol-1-yl)-2-butanone IUPAC Name: 1-bromo-3-methyl-1-(1,2,4-triazol-1-yl)butan-2-one Traditional Name: 1-bromo-3-methyl-1-(1,2,4-triazol-1-yl)butan-2-one Formula: C7H10BrN3O MolecularWeight: 232.0778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(N1C=NC=N1)Br

Isomeric SMILES

CC(C)C(=O)C(N1C=NC=N1)Br

InChI

InChI=1S/C7H10BrN3O/c1-5(2)6(12)7(8)11-4-9-3-10-11/h3-5,7H,1-2H3