1-(1-adamantyl)-2-[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]ethanone

Systemtic Name: 1-(1-adamantyl)-2-[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]ethanone Openeye Name: 1-(1-adamantyl)-2-[5-(4-bromophenyl)tetrazol-2-yl]ethanone CAS Name: 1-(1-adamantyl)-2-[5-(4-bromophenyl)-2-tetrazolyl]ethanone IUPAC Name: 1-(1-adamantyl)-2-[5-(4-bromophenyl)tetrazol-2-yl]ethanone Traditional Name: 1-(1-adamantyl)-2-[5-(4-bromophenyl)tetrazol-2-yl]ethanone Formula: C19H21BrN4O MolecularWeight: 401.30024

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)CN4N=C(N=N4)C5=CC=C(C=C5)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)CN4N=C(N=N4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C19H21BrN4O/c20-16-3-1-15(2-4-16)18-21-23-24(22-18)11-17(25)19-8-12-5-13(9-19)7-14(6-12)10-19/h1-4,12-14H,5-11H2