1-(5-methyl-2H-1,2,3-triazol-4-yl)but-2-yn-1-one

Systemtic Name: 1-(5-methyl-2H-1,2,3-triazol-4-yl)but-2-yn-1-one Openeye Name: 1-(5-methyl-2H-triazol-4-yl)but-2-yn-1-one CAS Name: 1-(5-methyl-2H-triazol-4-yl)-2-butyn-1-one IUPAC Name: 1-(5-methyl-2H-triazol-4-yl)but-2-yn-1-one Traditional Name: 1-(5-methyl-2H-triazol-4-yl)but-2-yn-1-one Formula: C7H7N3O MolecularWeight: 149.14998

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)C1=NNN=C1C

Isomeric SMILES

CC#CC(=O)C1=NNN=C1C

InChI

InChI=1S/C7H7N3O/c1-3-4-6(11)7-5(2)8-10-9-7/h1-2H3,(H,8,9,10)