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

Systemtic Name: [1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3-(2-phenylethanoylamino)propanoate Openeye Name: [2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 3-[(2-phenylacetyl)amino]propanoate CAS Name: 3-[(1-oxo-2-phenylethyl)amino]propanoic acid [1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1H-indol-3-yl)-1-oxopropan-2-yl] 3-[(2-phenylacetyl)amino]propanoate Traditional Name: 3-[(2-phenylacetyl)amino]propionic acid [2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CCNC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CCNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O4/c1-15(22(27)18-14-24-19-10-6-5-9-17(18)19)28-21(26)11-12-23-20(25)13-16-7-3-2-4-8-16/h2-10,14-15,24H,11-13H2,1H3,(H,23,25)