butyl 3-(4-chloranyl-2-nitro-phenyl)-2-cyano-propanoate

Systemtic Name: butyl 3-(4-chloranyl-2-nitro-phenyl)-2-cyano-propanoate Openeye Name: butyl 3-(4-chloro-2-nitro-phenyl)-2-cyano-propanoate CAS Name: 3-(4-chloro-2-nitrophenyl)-2-cyanopropanoic acid butyl ester IUPAC Name: butyl 3-(4-chloro-2-nitrophenyl)-2-cyanopropanoate Traditional Name: 3-(4-chloro-2-nitro-phenyl)-2-cyano-propionic acid butyl ester Formula: C14H15ClN2O4 MolecularWeight: 310.7329

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC1=C(C=C(C=C1)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CCCCOC(=O)C(CC1=C(C=C(C=C1)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H15ClN2O4/c1-2-3-6-21-14(18)11(9-16)7-10-4-5-12(15)8-13(10)17(19)20/h4-5,8,11H,2-3,6-7H2,1H3