ethyl 2-cyano-2-(1-cyano-2-methyl-6-nitro-3-oxidanylidene-isoindol-1-yl)ethanoate

Systemtic Name: ethyl 2-cyano-2-(1-cyano-2-methyl-6-nitro-3-oxidanylidene-isoindol-1-yl)ethanoate Openeye Name: ethyl 2-cyano-2-(1-cyano-2-methyl-6-nitro-3-oxo-isoindolin-1-yl)acetate CAS Name: 2-cyano-2-(1-cyano-2-methyl-6-nitro-3-oxo-1-isoindolyl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(1-cyano-2-methyl-6-nitro-3-oxoisoindol-1-yl)acetate Traditional Name: 2-cyano-2-(1-cyano-3-keto-2-methyl-6-nitro-isoindolin-1-yl)acetic acid ethyl ester Formula: C15H12N4O5 MolecularWeight: 328.27958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1(C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1C)C#N

Isomeric SMILES

CCOC(=O)C(C#N)C1(C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1C)C#N

InChI

InChI=1S/C15H12N4O5/c1-3-24-14(21)12(7-16)15(8-17)11-6-9(19(22)23)4-5-10(11)13(20)18(15)2/h4-6,12H,3H2,1-2H3