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

Systemtic Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl adamantane-2-carboxylate Openeye Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H21ClN2O3 MolecularWeight: 372.84534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C(=O)OCC4=NC(=NO4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C(=O)OCC4=NC(=NO4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C20H21ClN2O3/c21-16-3-1-13(2-4-16)19-22-17(26-23-19)10-25-20(24)18-14-6-11-5-12(8-14)9-15(18)7-11/h1-4,11-12,14-15,18H,5-10H2