methyl 2,3-dicyano-3-(4,5-dimethoxy-2-nitro-phenyl)propanoate

Systemtic Name: methyl 2,3-dicyano-3-(4,5-dimethoxy-2-nitro-phenyl)propanoate Openeye Name: methyl 2,3-dicyano-3-(4,5-dimethoxy-2-nitro-phenyl)propanoate CAS Name: 2,3-dicyano-3-(4,5-dimethoxy-2-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 2,3-dicyano-3-(4,5-dimethoxy-2-nitrophenyl)propanoate Traditional Name: 2,3-dicyano-3-(4,5-dimethoxy-2-nitro-phenyl)propionic acid methyl ester Formula: C14H13N3O6 MolecularWeight: 319.26952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(C#N)C(C#N)C(=O)OC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(C#N)C(C#N)C(=O)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C14H13N3O6/c1-21-12-4-8(11(17(19)20)5-13(12)22-2)9(6-15)10(7-16)14(18)23-3/h4-5,9-10H,1-3H3