[(1S)-2-oxidanylidenecyclohexyl] 2,4-dimethylquinoline-3-carboxylate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 2,4-dimethylquinoline-3-carboxylate Openeye Name: [(1S)-2-oxocyclohexyl] 2,4-dimethylquinoline-3-carboxylate CAS Name: 2,4-dimethyl-3-quinolinecarboxylic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 2,4-dimethylquinoline-3-carboxylate Traditional Name: 2,4-dimethylquinoline-3-carboxylic acid [(1S)-2-ketocyclohexyl] ester Formula: C18H19NO3 MolecularWeight: 297.34836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C)C(=O)OC3CCCCC3=O

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C)C(=O)O[C@H]3CCCCC3=O

InChI

InChI=1S/C18H19NO3/c1-11-13-7-3-4-8-14(13)19-12(2)17(11)18(21)22-16-10-6-5-9-15(16)20/h3-4,7-8,16H,5-6,9-10H2,1-2H3/t16-/m0/s1