(2R)-3-(1H-indol-3-yl)-2-[3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoylamino]propanoic acid

Systemtic Name: (2R)-3-(1H-indol-3-yl)-2-[3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoylamino]propanoic acid Openeye Name: (2R)-3-(1H-indol-3-yl)-2-[3-(3-oxo-4H-quinoxalin-2-yl)propanoylamino]propanoic acid CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[1-oxo-3-(3-oxo-4H-quinoxalin-2-yl)propyl]amino]propanoic acid IUPAC Name: (2R)-3-(1H-indol-3-yl)-2-[3-(3-oxo-4H-quinoxalin-2-yl)propanoylamino]propanoic acid Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[3-(3-keto-4H-quinoxalin-2-yl)propanoylamino]propionic acid Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)CCC3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@H](C(=O)O)NC(=O)CCC3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H20N4O4/c27-20(10-9-18-21(28)26-17-8-4-3-7-16(17)24-18)25-19(22(29)30)11-13-12-23-15-6-2-1-5-14(13)15/h1-8,12,19,23H,9-11H2,(H,25,27)(H,26,28)(H,29,30)/t19-/m1/s1