(4-chloranyl-3,5-dimethyl-phenyl) 4-chloranyl-3-nitro-benzoate

Systemtic Name: (4-chloranyl-3,5-dimethyl-phenyl) 4-chloranyl-3-nitro-benzoate Openeye Name: (4-chloro-3,5-dimethyl-phenyl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid (4-chloro-3,5-dimethylphenyl) ester IUPAC Name: (4-chloro-3,5-dimethylphenyl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid (4-chloro-3,5-dimethyl-phenyl) ester Formula: C15H11Cl2NO4 MolecularWeight: 340.15814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H11Cl2NO4/c1-8-5-11(6-9(2)14(8)17)22-15(19)10-3-4-12(16)13(7-10)18(20)21/h3-7H,1-2H3