[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl adamantane-1-carboxylate

Systemtic Name: [5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl adamantane-1-carboxylate Openeye Name: [5-(3-methoxyphenyl)isoxazol-3-yl]methyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [5-(3-methoxyphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [5-(3-methoxyphenyl)isoxazol-3-yl]methyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=NO2)COC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=NO2)COC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H25NO4/c1-25-19-4-2-3-17(8-19)20-9-18(23-27-20)13-26-21(24)22-10-14-5-15(11-22)7-16(6-14)12-22/h2-4,8-9,14-16H,5-7,10-13H2,1H3