[(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3-(2-methylphenoxy)propanoate

Systemtic Name: [(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3-(2-methylphenoxy)propanoate Openeye Name: [(1R)-2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 3-(2-methylphenoxy)propanoate CAS Name: 3-(2-methylphenoxy)propanoic acid [(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] 3-(2-methylphenoxy)propanoate Traditional Name: 3-(2-methylphenoxy)propionic acid [(1R)-2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C21H21NO4 MolecularWeight: 351.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCC(=O)OC(C)C(=O)C2=CNC3=CC=CC=C32

Isomeric SMILES

CC1=CC=CC=C1OCCC(=O)O[C@H](C)C(=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H21NO4/c1-14-7-3-6-10-19(14)25-12-11-20(23)26-15(2)21(24)17-13-22-18-9-5-4-8-16(17)18/h3-10,13,15,22H,11-12H2,1-2H3/t15-/m1/s1