ethyl 3-[9-nitro-2,3-bis(oxidanylidene)-4H-benzo[h]quinoxalin-1-yl]propanoate

Systemtic Name: ethyl 3-[9-nitro-2,3-bis(oxidanylidene)-4H-benzo[h]quinoxalin-1-yl]propanoate Openeye Name: ethyl 3-(9-nitro-2,3-dioxo-4H-benzo[h]quinoxalin-1-yl)propanoate CAS Name: 3-(9-nitro-2,3-dioxo-4H-benzo[h]quinoxalin-1-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(9-nitro-2,3-dioxo-4H-benzo[h]quinoxalin-1-yl)propanoate Traditional Name: 3-(2,3-diketo-9-nitro-4H-benzo[h]quinoxalin-1-yl)propionic acid ethyl ester Formula: C17H15N3O6 MolecularWeight: 357.3175

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C=CC3=C2C=C(C=C3)[N+](=O)[O-])NC(=O)C1=O

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=CC3=C2C=C(C=C3)[N+](=O)[O-])NC(=O)C1=O

InChI

InChI=1S/C17H15N3O6/c1-2-26-14(21)7-8-19-15-12-9-11(20(24)25)5-3-10(12)4-6-13(15)18-16(22)17(19)23/h3-6,9H,2,7-8H2,1H3,(H,18,22)