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

Systemtic Name: 3-methyl-1-(2-methyl-1,2,4-triazol-3-yl)butan-1-one Openeye Name: 3-methyl-1-(2-methyl-1,2,4-triazol-3-yl)butan-1-one CAS Name: 3-methyl-1-(2-methyl-1,2,4-triazol-3-yl)-1-butanone IUPAC Name: 3-methyl-1-(2-methyl-1,2,4-triazol-3-yl)butan-1-one Traditional Name: 3-methyl-1-(2-methyl-1,2,4-triazol-3-yl)butan-1-one Formula: C8H13N3O MolecularWeight: 167.20832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1=NC=NN1C

Isomeric SMILES

CC(C)CC(=O)C1=NC=NN1C

InChI

InChI=1S/C8H13N3O/c1-6(2)4-7(12)8-9-5-10-11(8)3/h5-6H,4H2,1-3H3