2-[2-(5-bromanylindol-1-yl)ethanoylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[2-(5-bromanylindol-1-yl)ethanoylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[[2-(5-bromoindol-1-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[2-(5-bromo-1-indolyl)-1-oxoethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[2-(5-bromoindol-1-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[[2-(5-bromoindol-1-yl)acetyl]amino]-3-(1H-indol-3-yl)propionic acid Formula: C21H18BrN3O3 MolecularWeight: 440.28992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)CN3C=CC4=C3C=CC(=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)CN3C=CC4=C3C=CC(=C4)Br

InChI

InChI=1S/C21H18BrN3O3/c22-15-5-6-19-13(9-15)7-8-25(19)12-20(26)24-18(21(27)28)10-14-11-23-17-4-2-1-3-16(14)17/h1-9,11,18,23H,10,12H2,(H,24,26)(H,27,28)