[2-[[(2S)-2-ethylhexyl]amino]-2-oxidanylidene-ethyl] quinoline-8-carboxylate

Systemtic Name: [2-[[(2S)-2-ethylhexyl]amino]-2-oxidanylidene-ethyl] quinoline-8-carboxylate Openeye Name: [2-[[(2S)-2-ethylhexyl]amino]-2-oxo-ethyl] quinoline-8-carboxylate CAS Name: 8-quinolinecarboxylic acid [2-[[(2S)-2-ethylhexyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-2-ethylhexyl]amino]-2-oxoethyl] quinoline-8-carboxylate Traditional Name: quinoline-8-carboxylic acid [2-[[(2S)-2-ethylhexyl]amino]-2-keto-ethyl] ester Formula: C20H26N2O3 MolecularWeight: 342.43204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)COC(=O)C1=CC=CC2=C1N=CC=C2

Isomeric SMILES

CCCC[C@H](CC)CNC(=O)COC(=O)C1=CC=CC2=C1N=CC=C2

InChI

InChI=1S/C20H26N2O3/c1-3-5-8-15(4-2)13-22-18(23)14-25-20(24)17-11-6-9-16-10-7-12-21-19(16)17/h6-7,9-12,15H,3-5,8,13-14H2,1-2H3,(H,22,23)/t15-/m0/s1