(3,4-dimethylphenyl) 2-chloranyl-5-nitro-benzoate

Systemtic Name: (3,4-dimethylphenyl) 2-chloranyl-5-nitro-benzoate Openeye Name: (3,4-dimethylphenyl) 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid (3,4-dimethylphenyl) ester Formula: C15H12ClNO4 MolecularWeight: 305.71308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C15H12ClNO4/c1-9-3-5-12(7-10(9)2)21-15(18)13-8-11(17(19)20)4-6-14(13)16/h3-8H,1-2H3