1-(benzotriazol-1-yl)-5-methyl-hexan-3-one

Systemtic Name: 1-(benzotriazol-1-yl)-5-methyl-hexan-3-one Openeye Name: 1-(benzotriazol-1-yl)-5-methyl-hexan-3-one CAS Name: 1-(1-benzotriazolyl)-5-methyl-3-hexanone IUPAC Name: 1-(benzotriazol-1-yl)-5-methylhexan-3-one Traditional Name: 1-(benzotriazol-1-yl)-5-methyl-hexan-3-one Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)CCN1C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)CC(=O)CCN1C2=CC=CC=C2N=N1

InChI

InChI=1S/C13H17N3O/c1-10(2)9-11(17)7-8-16-13-6-4-3-5-12(13)14-15-16/h3-6,10H,7-9H2,1-2H3