1-(1-adamantyl)-2-[3-(1,2,3,4-tetrazol-1-yl)phenoxy]ethanone

Systemtic Name: 1-(1-adamantyl)-2-[3-(1,2,3,4-tetrazol-1-yl)phenoxy]ethanone Openeye Name: 1-(1-adamantyl)-2-[3-(tetrazol-1-yl)phenoxy]ethanone CAS Name: 1-(1-adamantyl)-2-[3-(1-tetrazolyl)phenoxy]ethanone IUPAC Name: 1-(1-adamantyl)-2-[3-(tetrazol-1-yl)phenoxy]ethanone Traditional Name: 1-(1-adamantyl)-2-[3-(tetrazol-1-yl)phenoxy]ethanone Formula: C19H22N4O2 MolecularWeight: 338.40358

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC4=CC=CC(=C4)N5C=NN=N5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC4=CC=CC(=C4)N5C=NN=N5

InChI

InChI=1S/C19H22N4O2/c24-18(19-8-13-4-14(9-19)6-15(5-13)10-19)11-25-17-3-1-2-16(7-17)23-12-20-21-22-23/h1-3,7,12-15H,4-6,8-11H2