3-(1H-indol-3-yl)-2-(2-phenylpropanoylamino)propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-(2-phenylpropanoylamino)propanoic acid Openeye Name: 3-(1H-indol-3-yl)-2-(2-phenylpropanoylamino)propanoic acid CAS Name: 3-(1H-indol-3-yl)-2-[(1-oxo-2-phenylpropyl)amino]propanoic acid IUPAC Name: 3-(1H-indol-3-yl)-2-(2-phenylpropanoylamino)propanoic acid Traditional Name: 2-(hydratropoylamino)-3-(1H-indol-3-yl)propionic acid Formula: C20H20N2O3 MolecularWeight: 336.3844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C20H20N2O3/c1-13(14-7-3-2-4-8-14)19(23)22-18(20(24)25)11-15-12-21-17-10-6-5-9-16(15)17/h2-10,12-13,18,21H,11H2,1H3,(H,22,23)(H,24,25)