[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-(1H-indol-3-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-(1H-indol-3-yl)propanoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C22H23NO3 MolecularWeight: 349.42292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)CCC2=CNC3=CC=CC=C32)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)CCC2=CNC3=CC=CC=C32)C)C

InChI

InChI=1S/C22H23NO3/c1-14-10-16(3)19(11-15(14)2)21(24)13-26-22(25)9-8-17-12-23-20-7-5-4-6-18(17)20/h4-7,10-12,23H,8-9,13H2,1-3H3