[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl (5S,7R)-3-acetamidoadamantane-1-carboxylate

Systemtic Name: [5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl (5S,7R)-3-acetamidoadamantane-1-carboxylate Openeye Name: [5-(4-fluorophenyl)oxazol-2-yl]methyl (5S,7R)-3-acetamidoadamantane-1-carboxylate CAS Name: (5S,7R)-3-acetamido-1-adamantanecarboxylic acid [5-(4-fluorophenyl)-2-oxazolyl]methyl ester IUPAC Name: [5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl (5S,7R)-3-acetamidoadamantane-1-carboxylate Traditional Name: (5S,7R)-3-acetamidoadamantane-1-carboxylic acid [5-(4-fluorophenyl)oxazol-2-yl]methyl ester Formula: C23H25FN2O4 MolecularWeight: 412.454003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC4=NC=C(O4)C5=CC=C(C=C5)F

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)OCC4=NC=C(O4)C5=CC=C(C=C5)F

InChI

InChI=1S/C23H25FN2O4/c1-14(27)26-23-9-15-6-16(10-23)8-22(7-15,13-23)21(28)29-12-20-25-11-19(30-20)17-2-4-18(24)5-3-17/h2-5,11,15-16H,6-10,12-13H2,1H3,(H,26,27)/t15-,16+,22?,23?