[1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: [1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: [1-methyl-2-(2-methylanilino)-2-oxo-ethyl] 9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: 9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid [1-(2-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylanilino)-1-oxopropan-2-yl] 9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 9-ketobicyclo[3.3.1]nonane-3-carboxylic acid [2-keto-1-methyl-2-(o-toluidino)ethyl] ester Formula: C20H25NO4 MolecularWeight: 343.4168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2CC3CCCC(C2)C3=O

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2CC3CCCC(C2)C3=O

InChI

InChI=1S/C20H25NO4/c1-12-6-3-4-9-17(12)21-19(23)13(2)25-20(24)16-10-14-7-5-8-15(11-16)18(14)22/h3-4,6,9,13-16H,5,7-8,10-11H2,1-2H3,(H,21,23)