cyanomethyl 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate

Systemtic Name: cyanomethyl 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate Openeye Name: cyanomethyl 2-(4-chloro-3-nitro-benzoyl)benzoate CAS Name: 2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(4-chloro-3-nitrobenzoyl)benzoate Traditional Name: 2-(4-chloro-3-nitro-benzoyl)benzoic acid cyanomethyl ester Formula: C16H9ClN2O5 MolecularWeight: 344.70606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9ClN2O5/c17-13-6-5-10(9-14(13)19(22)23)15(20)11-3-1-2-4-12(11)16(21)24-8-7-18/h1-6,9H,8H2