[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl] (5S,7R)-3-(4-methoxyphenyl)adamantane-1-carboxylate

Systemtic Name: [2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl] (5S,7R)-3-(4-methoxyphenyl)adamantane-1-carboxylate Openeye Name: [2-(isoxazol-3-ylamino)-2-oxo-ethyl] (5S,7R)-3-(4-methoxyphenyl)adamantane-1-carboxylate CAS Name: (5S,7R)-3-(4-methoxyphenyl)-1-adamantanecarboxylic acid [2-(3-isoxazolylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,2-oxazol-3-ylamino)-2-oxoethyl] (5S,7R)-3-(4-methoxyphenyl)adamantane-1-carboxylate Traditional Name: (5S,7R)-3-(4-methoxyphenyl)adamantane-1-carboxylic acid [2-(isoxazol-3-ylamino)-2-keto-ethyl] ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)OCC(=O)NC5=NOC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)C(=O)OCC(=O)NC5=NOC=C5

InChI

InChI=1S/C23H26N2O5/c1-28-18-4-2-17(3-5-18)22-9-15-8-16(10-22)12-23(11-15,14-22)21(27)29-13-20(26)24-19-6-7-30-25-19/h2-7,15-16H,8-14H2,1H3,(H,24,25,26)/t15-,16+,22?,23?