ethyl 2-cyano-2-[4-nitro-9,10-bis(oxidanylidene)anthracen-1-yl]ethanoate

Systemtic Name: ethyl 2-cyano-2-[4-nitro-9,10-bis(oxidanylidene)anthracen-1-yl]ethanoate Openeye Name: ethyl 2-cyano-2-(4-nitro-9,10-dioxo-1-anthryl)acetate CAS Name: 2-cyano-2-(4-nitro-9,10-dioxo-1-anthracenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(4-nitro-9,10-dioxoanthracen-1-yl)acetate Traditional Name: 2-cyano-2-(9,10-diketo-4-nitro-1-anthryl)acetic acid ethyl ester Formula: C19H12N2O6 MolecularWeight: 364.30838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1=C2C(=C(C=C1)[N+](=O)[O-])C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C(C#N)C1=C2C(=C(C=C1)[N+](=O)[O-])C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H12N2O6/c1-2-27-19(24)13(9-20)10-7-8-14(21(25)26)16-15(10)17(22)11-5-3-4-6-12(11)18(16)23/h3-8,13H,2H2,1H3