(4-cyanophenyl) 5-chloranyl-2-nitro-benzoate

Systemtic Name: (4-cyanophenyl) 5-chloranyl-2-nitro-benzoate Openeye Name: (4-cyanophenyl) 5-chloro-2-nitro-benzoate CAS Name: 5-chloro-2-nitrobenzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 5-chloro-2-nitrobenzoate Traditional Name: 5-chloro-2-nitro-benzoic acid (4-cyanophenyl) ester Formula: C14H7ClN2O4 MolecularWeight: 302.66938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H7ClN2O4/c15-10-3-6-13(17(19)20)12(7-10)14(18)21-11-4-1-9(8-16)2-5-11/h1-7H