[4-[(3-methylphenyl)carbonylamino]phenyl] 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: [4-[(3-methylphenyl)carbonylamino]phenyl] 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: [4-[(3-methylbenzoyl)amino]phenyl] 9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: 9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid [4-[[(3-methylphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(3-methylbenzoyl)amino]phenyl] 9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 9-ketobicyclo[3.3.1]nonane-3-carboxylic acid [4-(m-toluoylamino)phenyl] ester Formula: C24H25NO4 MolecularWeight: 391.4596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)OC(=O)C3CC4CCCC(C3)C4=O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)OC(=O)C3CC4CCCC(C3)C4=O

InChI

InChI=1S/C24H25NO4/c1-15-4-2-7-18(12-15)23(27)25-20-8-10-21(11-9-20)29-24(28)19-13-16-5-3-6-17(14-19)22(16)26/h2,4,7-12,16-17,19H,3,5-6,13-14H2,1H3,(H,25,27)