(2S)-2-(benzotriazol-1-yl)cyclohexan-1-one

Systemtic Name: (2S)-2-(benzotriazol-1-yl)cyclohexan-1-one Openeye Name: (2S)-2-(benzotriazol-1-yl)cyclohexanone CAS Name: (2S)-2-(1-benzotriazolyl)-1-cyclohexanone IUPAC Name: (2S)-2-(benzotriazol-1-yl)cyclohexan-1-one Traditional Name: (2S)-2-(benzotriazol-1-yl)cyclohexanone Formula: C12H13N3O MolecularWeight: 215.25112

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

C1CCC(=O)[C@H](C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C12H13N3O/c16-12-8-4-3-7-11(12)15-10-6-2-1-5-9(10)13-14-15/h1-2,5-6,11H,3-4,7-8H2/t11-/m0/s1