2-nitro-3-oxidanyl-3-quinoxalin-2-yl-propanoic acid

Systemtic Name: 2-nitro-3-oxidanyl-3-quinoxalin-2-yl-propanoic acid Openeye Name: 3-hydroxy-2-nitro-3-quinoxalin-2-yl-propanoic acid CAS Name: 3-hydroxy-2-nitro-3-(2-quinoxalinyl)propanoic acid IUPAC Name: 3-hydroxy-2-nitro-3-quinoxalin-2-ylpropanoic acid Traditional Name: 3-hydroxy-2-nitro-3-quinoxalin-2-yl-propionic acid Formula: C11H9N3O5 MolecularWeight: 263.20626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CC(=N2)C(C(C(=O)O)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)N=CC(=N2)C(C(C(=O)O)[N+](=O)[O-])O

InChI

InChI=1S/C11H9N3O5/c15-10(9(11(16)17)14(18)19)8-5-12-6-3-1-2-4-7(6)13-8/h1-5,9-10,15H,(H,16,17)