N-(1-adamantyl)-4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidine-1-carboxamide

Systemtic Name: N-(1-adamantyl)-4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidine-1-carboxamide Openeye Name: N-(1-adamantyl)-4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidine-1-carboxamide CAS Name: N-(1-adamantyl)-4-[5-(trifluoromethyl)-1-benzotriazolyl]-1-piperidinecarboxamide IUPAC Name: N-(1-adamantyl)-4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidine-1-carboxamide Traditional Name: N-(1-adamantyl)-4-[5-(trifluoromethyl)benzotriazol-1-yl]piperidine-1-carboxamide Formula: C23H28F3N5O MolecularWeight: 447.49653

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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)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCC1N2C3=C(C=C(C=C3)C(F)(F)F)N=N2)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C23H28F3N5O/c24-23(25,26)17-1-2-20-19(10-17)28-29-31(20)18-3-5-30(6-4-18)21(32)27-22-11-14-7-15(12-22)9-16(8-14)13-22/h1-2,10,14-16,18H,3-9,11-13H2,(H,27,32)