3-[(3-oxidanylidene-4H-quinoxalin-2-yl)methylamino]propanoic acid

Systemtic Name: 3-[(3-oxidanylidene-4H-quinoxalin-2-yl)methylamino]propanoic acid Openeye Name: 3-[(3-oxo-4H-quinoxalin-2-yl)methylamino]propanoic acid CAS Name: 3-[(3-oxo-4H-quinoxalin-2-yl)methylamino]propanoic acid IUPAC Name: 3-[(3-oxo-4H-quinoxalin-2-yl)methylamino]propanoic acid Traditional Name: 3-[(3-keto-4H-quinoxalin-2-yl)methylamino]propionic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(=N2)CNCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(=N2)CNCCC(=O)O

InChI

InChI=1S/C12H13N3O3/c16-11(17)5-6-13-7-10-12(18)15-9-4-2-1-3-8(9)14-10/h1-4,13H,5-7H2,(H,15,18)(H,16,17)