(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 3-oxidanyladamantane-1-carboxylate

Systemtic Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 3-oxidanyladamantane-1-carboxylate Openeye Name: (5-methyl-2-phenyl-oxazol-4-yl)methyl 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid (5-methyl-2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid (5-methyl-2-phenyl-oxazol-4-yl)methyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)COC(=O)C34CC5CC(C3)CC(C5)(C4)O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)COC(=O)C34CC5CC(C3)CC(C5)(C4)O

InChI

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