1-[4-[5-(1-adamantyl)-1,2,3-triazol-1-yl]phenyl]-2-chloranyl-ethanone

Systemtic Name: 1-[4-[5-(1-adamantyl)-1,2,3-triazol-1-yl]phenyl]-2-chloranyl-ethanone Openeye Name: 1-[4-[5-(1-adamantyl)triazol-1-yl]phenyl]-2-chloro-ethanone CAS Name: 1-[4-[5-(1-adamantyl)-1-triazolyl]phenyl]-2-chloroethanone IUPAC Name: 1-[4-[5-(1-adamantyl)triazol-1-yl]phenyl]-2-chloroethanone Traditional Name: 1-[4-[5-(1-adamantyl)triazol-1-yl]phenyl]-2-chloro-ethanone Formula: C20H22ClN3O MolecularWeight: 355.86118

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CN=NN4C5=CC=C(C=C5)C(=O)CCl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CN=NN4C5=CC=C(C=C5)C(=O)CCl

InChI

InChI=1S/C20H22ClN3O/c21-11-18(25)16-1-3-17(4-2-16)24-19(12-22-23-24)20-8-13-5-14(9-20)7-15(6-13)10-20/h1-4,12-15H,5-11H2