ethyl 2-[5,7-dinitro-2,3-bis(oxidanylidene)indol-1-yl]ethanoate

Systemtic Name: ethyl 2-[5,7-dinitro-2,3-bis(oxidanylidene)indol-1-yl]ethanoate Openeye Name: ethyl 2-(5,7-dinitro-2,3-dioxo-indolin-1-yl)acetate CAS Name: 2-(5,7-dinitro-2,3-dioxo-1-indolyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(5,7-dinitro-2,3-dioxoindol-1-yl)acetate Traditional Name: 2-(2,3-diketo-5,7-dinitro-indolin-1-yl)acetic acid ethyl ester Formula: C12H9N3O8 MolecularWeight: 323.21516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2C(=O)C1=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2C(=O)C1=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O8/c1-2-23-9(16)5-13-10-7(11(17)12(13)18)3-6(14(19)20)4-8(10)15(21)22/h3-4H,2,5H2,1H3