1-(benzotriazol-1-yl)-2-cyclohexyl-ethanone

Systemtic Name: 1-(benzotriazol-1-yl)-2-cyclohexyl-ethanone Openeye Name: 1-(benzotriazol-1-yl)-2-cyclohexyl-ethanone CAS Name: 1-(1-benzotriazolyl)-2-cyclohexylethanone IUPAC Name: 1-(benzotriazol-1-yl)-2-cyclohexylethanone Traditional Name: 1-(benzotriazol-1-yl)-2-cyclohexyl-ethanone Formula: C14H17N3O MolecularWeight: 243.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

C1CCC(CC1)CC(=O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C14H17N3O/c18-14(10-11-6-2-1-3-7-11)17-13-9-5-4-8-12(13)15-16-17/h4-5,8-9,11H,1-3,6-7,10H2