[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-oxidanyladamantane-1-carboxylate

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-oxidanyladamantane-1-carboxylate Openeye Name: [2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid [2-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(dimethylamino)-2-oxo-1-phenylethyl] 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid [2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C21H27NO4 MolecularWeight: 357.44338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1=CC=CC=C1)OC(=O)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CN(C)C(=O)C(C1=CC=CC=C1)OC(=O)C23CC4CC(C2)CC(C4)(C3)O

InChI

InChI=1S/C21H27NO4/c1-22(2)18(23)17(16-6-4-3-5-7-16)26-19(24)20-9-14-8-15(10-20)12-21(25,11-14)13-20/h3-7,14-15,17,25H,8-13H2,1-2H3