[4-(4-cyanophenyl)phenyl] 2-chloranyl-5-nitro-benzoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 2-chloranyl-5-nitro-benzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C20H11ClN2O4 MolecularWeight: 378.76534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)OC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)OC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H11ClN2O4/c21-19-10-7-16(23(25)26)11-18(19)20(24)27-17-8-5-15(6-9-17)14-3-1-13(12-22)2-4-14/h1-11H