[(1S)-2-oxidanylidenecyclohexyl] (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [(1S)-2-oxocyclohexyl] (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [(1S)-2-ketocyclohexyl] ester Formula: C24H29NO3 MolecularWeight: 379.49196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OC4CCCCC4=O

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)O[C@H]4CCCCC4=O

InChI

InChI=1S/C24H29NO3/c1-24(2,3)15-12-13-19-17(14-15)22(16-8-4-5-9-18(16)25-19)23(27)28-21-11-7-6-10-20(21)26/h4-5,8-9,15,21H,6-7,10-14H2,1-3H3/t15-,21-/m0/s1