2-[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]ethanoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]ethanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]-3-phenyl-propionic acid Formula: C22H24N4O4 MolecularWeight: 408.45036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O4/c23-17(11-15-12-24-18-9-5-4-8-16(15)18)21(28)25-13-20(27)26-19(22(29)30)10-14-6-2-1-3-7-14/h1-9,12,17,19,24H,10-11,13,23H2,(H,25,28)(H,26,27)(H,29,30)