1-adamantyl-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]methanone Openeye Name: 1-adamantyl-[4-[5-(trifluoromethyl)benzotriazol-1-yl]-1-piperidyl]methanone CAS Name: 1-adamantyl-[4-[5-(trifluoromethyl)-1-benzotriazolyl]-1-piperidinyl]methanone IUPAC Name: 1-adamantyl-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidin-1-yl]methanone Traditional Name: 1-adamantyl-[4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidino]methanone Formula: C23H27F3N4O MolecularWeight: 432.48189

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(C=C(C=C3)C(F)(F)F)N=N2)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCC1N2C3=C(C=C(C=C3)C(F)(F)F)N=N2)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C23H27F3N4O/c24-23(25,26)17-1-2-20-19(10-17)27-28-30(20)18-3-5-29(6-4-18)21(31)22-11-14-7-15(12-22)9-16(8-14)13-22/h1-2,10,14-16,18H,3-9,11-13H2