1-(benzotriazol-1-yl)-4-chloranyl-3,3-dimethyl-butan-2-one

Systemtic Name: 1-(benzotriazol-1-yl)-4-chloranyl-3,3-dimethyl-butan-2-one Openeye Name: 1-(benzotriazol-1-yl)-4-chloro-3,3-dimethyl-butan-2-one CAS Name: 1-(1-benzotriazolyl)-4-chloro-3,3-dimethyl-2-butanone IUPAC Name: 1-(benzotriazol-1-yl)-4-chloro-3,3-dimethylbutan-2-one Traditional Name: 1-(benzotriazol-1-yl)-4-chloro-3,3-dimethyl-butan-2-one Formula: C12H14ClN3O MolecularWeight: 251.71206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)C(=O)CN1C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)(CCl)C(=O)CN1C2=CC=CC=C2N=N1

InChI

InChI=1S/C12H14ClN3O/c1-12(2,8-13)11(17)7-16-10-6-4-3-5-9(10)14-15-16/h3-6H,7-8H2,1-2H3