[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] (5S,7R)-3-phenyladamantane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] (5S,7R)-3-phenyladamantane-1-carboxylate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] (5S,7R)-3-phenyladamantane-1-carboxylate CAS Name: (5S,7R)-3-phenyl-1-adamantanecarboxylic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] (5S,7R)-3-phenyladamantane-1-carboxylate Traditional Name: (5S,7R)-3-phenyladamantane-1-carboxylic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C23H25NO3 MolecularWeight: 363.4495

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C(=O)OCC(=O)C4=CC=CN4)C5=CC=CC=C5

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)C(=O)OCC(=O)C4=CC=CN4)C5=CC=CC=C5

InChI

InChI=1S/C23H25NO3/c25-20(19-7-4-8-24-19)14-27-21(26)23-12-16-9-17(13-23)11-22(10-16,15-23)18-5-2-1-3-6-18/h1-8,16-17,24H,9-15H2/t16-,17+,22?,23?