ethyl 2-[7-imidazol-1-yl-6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]ethanoate

Systemtic Name: ethyl 2-[7-imidazol-1-yl-6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]ethanoate Openeye Name: ethyl 2-(7-imidazol-1-yl-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)acetate CAS Name: 2-[7-(1-imidazolyl)-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-(7-imidazol-1-yl-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)acetate Traditional Name: 2-(7-imidazol-1-yl-2,3-diketo-6-nitro-4H-quinoxalin-1-yl)acetic acid ethyl ester Formula: C15H13N5O6 MolecularWeight: 359.29362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC(=C(C=C2NC(=O)C1=O)[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

CCOC(=O)CN1C2=CC(=C(C=C2NC(=O)C1=O)[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C15H13N5O6/c1-2-26-13(21)7-19-10-6-11(18-4-3-16-8-18)12(20(24)25)5-9(10)17-14(22)15(19)23/h3-6,8H,2,7H2,1H3,(H,17,22)