2-[6-azanyl-7-imidazol-1-yl-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]ethanoic acid

Systemtic Name: 2-[6-azanyl-7-imidazol-1-yl-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]ethanoic acid Openeye Name: 2-(6-amino-7-imidazol-1-yl-2,3-dioxo-4H-quinoxalin-1-yl)acetic acid CAS Name: 2-[6-amino-7-(1-imidazolyl)-2,3-dioxo-4H-quinoxalin-1-yl]acetic acid IUPAC Name: 2-(6-amino-7-imidazol-1-yl-2,3-dioxo-4H-quinoxalin-1-yl)acetic acid Traditional Name: 2-(6-amino-7-imidazol-1-yl-2,3-diketo-4H-quinoxalin-1-yl)acetic acid Formula: C13H11N5O4 MolecularWeight: 301.25754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)C2=C(C=C3C(=C2)N(C(=O)C(=O)N3)CC(=O)O)N

Isomeric SMILES

C1=CN(C=N1)C2=C(C=C3C(=C2)N(C(=O)C(=O)N3)CC(=O)O)N

InChI

InChI=1S/C13H11N5O4/c14-7-3-8-10(4-9(7)17-2-1-15-6-17)18(5-11(19)20)13(22)12(21)16-8/h1-4,6H,5,14H2,(H,16,21)(H,19,20)