methyl 3-chloranyl-2-cyano-3-(4-nitrophenyl)-2-oxidanyl-propanoate

Systemtic Name: methyl 3-chloranyl-2-cyano-3-(4-nitrophenyl)-2-oxidanyl-propanoate Openeye Name: methyl 3-chloro-2-cyano-2-hydroxy-3-(4-nitrophenyl)propanoate CAS Name: 3-chloro-2-cyano-2-hydroxy-3-(4-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 3-chloro-2-cyano-2-hydroxy-3-(4-nitrophenyl)propanoate Traditional Name: 3-chloro-2-cyano-2-hydroxy-3-(4-nitrophenyl)propionic acid methyl ester Formula: C11H9ClN2O5 MolecularWeight: 284.65256

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)(C(C1=CC=C(C=C1)[N+](=O)[O-])Cl)O

Isomeric SMILES

COC(=O)C(C#N)(C(C1=CC=C(C=C1)[N+](=O)[O-])Cl)O

InChI

InChI=1S/C11H9ClN2O5/c1-19-10(15)11(16,6-13)9(12)7-2-4-8(5-3-7)14(17)18/h2-5,9,16H,1H3