methyl 2-cyano-2-(5-methyl-2-nitro-phenyl)ethanoate

Systemtic Name: methyl 2-cyano-2-(5-methyl-2-nitro-phenyl)ethanoate Openeye Name: methyl 2-cyano-2-(5-methyl-2-nitro-phenyl)acetate CAS Name: 2-cyano-2-(5-methyl-2-nitrophenyl)acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-(5-methyl-2-nitrophenyl)acetate Traditional Name: 2-cyano-2-(5-methyl-2-nitro-phenyl)acetic acid methyl ester Formula: C11H10N2O4 MolecularWeight: 234.2081

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])C(C#N)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])C(C#N)C(=O)OC

InChI

InChI=1S/C11H10N2O4/c1-7-3-4-10(13(15)16)8(5-7)9(6-12)11(14)17-2/h3-5,9H,1-2H3