[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl adamantane-1-carboxylate

Systemtic Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl adamantane-1-carboxylate Openeye Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H21BrN2O3 MolecularWeight: 417.29634

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)OCC4=NC(=NO4)C5=CC(=CC=C5)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)OCC4=NC(=NO4)C5=CC(=CC=C5)Br

InChI

InChI=1S/C20H21BrN2O3/c21-16-3-1-2-15(7-16)18-22-17(26-23-18)11-25-19(24)20-8-12-4-13(9-20)6-14(5-12)10-20/h1-3,7,12-14H,4-6,8-11H2