[(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] adamantane-2-carboxylate

Systemtic Name: [(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] adamantane-2-carboxylate Openeye Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [(1R)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)C3C4CC5CC(C4)CC3C5

Isomeric SMILES

C1CC1NC(=O)[C@@H](C2=CC=CC=C2)OC(=O)C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C22H27NO3/c24-21(23-18-6-7-18)20(15-4-2-1-3-5-15)26-22(25)19-16-9-13-8-14(11-16)12-17(19)10-13/h1-5,13-14,16-20H,6-12H2,(H,23,24)/t13?,14?,16?,17?,19?,20-/m1/s1