[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl (5S,7R)-3-oxidanyladamantane-1-carboxylate

Systemtic Name: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl (5S,7R)-3-oxidanyladamantane-1-carboxylate Openeye Name: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl (5S,7R)-3-hydroxyadamantane-1-carboxylate CAS Name: (5S,7R)-3-hydroxy-1-adamantanecarboxylic acid [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl (5S,7R)-3-hydroxyadamantane-1-carboxylate Traditional Name: (5S,7R)-3-hydroxyadamantane-1-carboxylic acid [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NOC(=N2)COC(=O)C34CC5CC(C3)CC(C5)(C4)O

Isomeric SMILES

COC1=CC=CC(=C1)C2=NOC(=N2)COC(=O)C34C[C@H]5C[C@@H](C3)CC(C5)(C4)O

InChI

InChI=1S/C21H24N2O5/c1-26-16-4-2-3-15(6-16)18-22-17(28-23-18)11-27-19(24)20-7-13-5-14(8-20)10-21(25,9-13)12-20/h2-4,6,13-14,25H,5,7-12H2,1H3/t13-,14+,20?,21?