3,3-dimethyl-1-(1,2,3-triazol-1-yl)butan-2-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C=CN=N1

Isomeric SMILES

CC(C)(C)C(=O)CN1C=CN=N1

InChI

InChI=1S/C8H13N3O/c1-8(2,3)7(12)6-11-5-4-9-10-11/h4-5H,6H2,1-3H3