(2R)-2-[[2-(5-nitro-1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]propanoic acid

Systemtic Name: (2R)-2-[[2-(5-nitro-1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]propanoic acid Openeye Name: (2R)-2-[[2-(5-nitro-1H-indol-3-yl)-2-oxo-acetyl]amino]propanoic acid CAS Name: (2R)-2-[[2-(5-nitro-1H-indol-3-yl)-1,2-dioxoethyl]amino]propanoic acid IUPAC Name: (2R)-2-[[2-(5-nitro-1H-indol-3-yl)-2-oxoacetyl]amino]propanoic acid Traditional Name: (2R)-2-[[2-keto-2-(5-nitro-1H-indol-3-yl)acetyl]amino]propionic acid Formula: C13H11N3O6 MolecularWeight: 305.24294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C(=O)C1=CNC2=C1C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)O)NC(=O)C(=O)C1=CNC2=C1C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O6/c1-6(13(19)20)15-12(18)11(17)9-5-14-10-3-2-7(16(21)22)4-8(9)10/h2-6,14H,1H3,(H,15,18)(H,19,20)/t6-/m1/s1