[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-acetamidoadamantane-1-carboxylate

Systemtic Name: [3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-acetamidoadamantane-1-carboxylate Openeye Name: [3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl 3-acetamidoadamantane-1-carboxylate CAS Name: 3-acetamido-1-adamantanecarboxylic acid [3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-acetamidoadamantane-1-carboxylate Traditional Name: 3-acetamidoadamantane-1-carboxylic acid [3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C34CC5CC(C3)CC(C5)(C4)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C34CC5CC(C3)CC(C5)(C4)NC(=O)C

InChI

InChI=1S/C23H27N3O4/c1-14-3-5-18(6-4-14)20-24-19(30-26-20)12-29-21(28)22-8-16-7-17(9-22)11-23(10-16,13-22)25-15(2)27/h3-6,16-17H,7-13H2,1-2H3,(H,25,27)