[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] (5R,7R)-3-oxidanyladamantane-1-carboxylate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] (5R,7R)-3-oxidanyladamantane-1-carboxylate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] (5R,7R)-3-hydroxyadamantane-1-carboxylate CAS Name: (5R,7R)-3-hydroxy-1-adamantanecarboxylic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] (5R,7R)-3-hydroxyadamantane-1-carboxylate Traditional Name: (5R,7R)-3-hydroxyadamantane-1-carboxylic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H25NO4 MolecularWeight: 307.3847

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

C[C@H](C(=O)NC1CC1)OC(=O)C23C[C@H]4C[C@H](C2)CC(C4)(C3)O

InChI

InChI=1S/C17H25NO4/c1-10(14(19)18-13-2-3-13)22-15(20)16-5-11-4-12(6-16)8-17(21,7-11)9-16/h10-13,21H,2-9H2,1H3,(H,18,19)/t10-,11-,12-,16?,17?/m1/s1