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

Systemtic Name: 1-adamantyl-[4-(5-fluoranylbenzotriazol-1-yl)piperidin-1-yl]methanone Openeye Name: 1-adamantyl-[4-(5-fluorobenzotriazol-1-yl)-1-piperidyl]methanone CAS Name: 1-adamantyl-[4-(5-fluoro-1-benzotriazolyl)-1-piperidinyl]methanone IUPAC Name: 1-adamantyl-[4-(5-fluorobenzotriazol-1-yl)piperidin-1-yl]methanone Traditional Name: 1-adamantyl-[4-(5-fluorobenzotriazol-1-yl)piperidino]methanone Formula: C22H27FN4O MolecularWeight: 382.474383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27FN4O/c23-17-1-2-20-19(10-17)24-25-27(20)18-3-5-26(6-4-18)21(28)22-11-14-7-15(12-22)9-16(8-14)13-22/h1-2,10,14-16,18H,3-9,11-13H2