[2-[(2-cyano-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(2-chloranyl-6-fluoranyl-phenyl)ethanoate

Systemtic Name: [2-[(2-cyano-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(2-chloranyl-6-fluoranyl-phenyl)ethanoate Openeye Name: [2-(2-cyano-4-nitro-anilino)-2-oxo-ethyl] 2-(2-chloro-6-fluoro-phenyl)acetate CAS Name: 2-(2-chloro-6-fluorophenyl)acetic acid [2-(2-cyano-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyano-4-nitroanilino)-2-oxoethyl] 2-(2-chloro-6-fluorophenyl)acetate Traditional Name: 2-(2-chloro-6-fluoro-phenyl)acetic acid [2-(2-cyano-4-nitro-anilino)-2-keto-ethyl] ester Formula: C17H11ClFN3O5 MolecularWeight: 391.737743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CC(=O)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CC(=O)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)F

InChI

InChI=1S/C17H11ClFN3O5/c18-13-2-1-3-14(19)12(13)7-17(24)27-9-16(23)21-15-5-4-11(22(25)26)6-10(15)8-20/h1-6H,7,9H2,(H,21,23)