[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] adamantane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] adamantane-1-carboxylate Openeye Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (2-keto-2-mesidino-ethyl) ester Formula: C22H29NO3 MolecularWeight: 355.47056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)C23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)C23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C22H29NO3/c1-13-4-14(2)20(15(3)5-13)23-19(24)12-26-21(25)22-9-16-6-17(10-22)8-18(7-16)11-22/h4-5,16-18H,6-12H2,1-3H3,(H,23,24)