(3,5-dimethylphenyl) 4-methoxy-3-nitro-benzoate

Systemtic Name: (3,5-dimethylphenyl) 4-methoxy-3-nitro-benzoate Openeye Name: (3,5-dimethylphenyl) 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid (3,5-dimethylphenyl) ester Formula: C16H15NO5 MolecularWeight: 301.294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO5/c1-10-6-11(2)8-13(7-10)22-16(18)12-4-5-15(21-3)14(9-12)17(19)20/h4-9H,1-3H3