(3-methyl-1,2,4-oxadiazol-5-yl)methyl 3-(4-methoxyphenyl)adamantane-1-carboxylate

Systemtic Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl 3-(4-methoxyphenyl)adamantane-1-carboxylate Openeye Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl 3-(4-methoxyphenyl)adamantane-1-carboxylate CAS Name: 3-(4-methoxyphenyl)-1-adamantanecarboxylic acid (3-methyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl 3-(4-methoxyphenyl)adamantane-1-carboxylate Traditional Name: 3-(4-methoxyphenyl)adamantane-1-carboxylic acid (3-methyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)COC(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=NOC(=N1)COC(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)OC

InChI

InChI=1S/C22H26N2O4/c1-14-23-19(28-24-14)12-27-20(25)22-10-15-7-16(11-22)9-21(8-15,13-22)17-3-5-18(26-2)6-4-17/h3-6,15-16H,7-13H2,1-2H3