[4-[2-(4-chlorophenyl)-2-cyano-ethenyl]-2-methoxy-phenyl] 2-chloranyl-5-nitro-benzoate

Systemtic Name: [4-[2-(4-chlorophenyl)-2-cyano-ethenyl]-2-methoxy-phenyl] 2-chloranyl-5-nitro-benzoate Openeye Name: [4-[2-(4-chlorophenyl)-2-cyano-vinyl]-2-methoxy-phenyl] 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid [4-[2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl] 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid [4-[2-(4-chlorophenyl)-2-cyano-vinyl]-2-methoxy-phenyl] ester Formula: C23H14Cl2N2O5 MolecularWeight: 469.27366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)Cl)OC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)Cl)OC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H14Cl2N2O5/c1-31-22-11-14(10-16(13-26)15-3-5-17(24)6-4-15)2-9-21(22)32-23(28)19-12-18(27(29)30)7-8-20(19)25/h2-12H,1H3