(3S)-1-(benzotriazol-1-yl)-3,5,5-trimethyl-hexan-1-one

Systemtic Name: (3S)-1-(benzotriazol-1-yl)-3,5,5-trimethyl-hexan-1-one Openeye Name: (3S)-1-(benzotriazol-1-yl)-3,5,5-trimethyl-hexan-1-one CAS Name: (3S)-1-(1-benzotriazolyl)-3,5,5-trimethyl-1-hexanone IUPAC Name: (3S)-1-(benzotriazol-1-yl)-3,5,5-trimethylhexan-1-one Traditional Name: (3S)-1-(benzotriazol-1-yl)-3,5,5-trimethyl-hexan-1-one Formula: C15H21N3O MolecularWeight: 259.34674

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1C2=CC=CC=C2N=N1)CC(C)(C)C

Isomeric SMILES

C[C@H](CC(=O)N1C2=CC=CC=C2N=N1)CC(C)(C)C

InChI

InChI=1S/C15H21N3O/c1-11(10-15(2,3)4)9-14(19)18-13-8-6-5-7-12(13)16-17-18/h5-8,11H,9-10H2,1-4H3/t11-/m1/s1