[4-(phenylcarbonyl)phenyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [4-(phenylcarbonyl)phenyl] 3-methyl-4-nitro-benzoate Openeye Name: (4-benzoylphenyl) 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid (4-benzoylphenyl) ester IUPAC Name: (4-benzoylphenyl) 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid (4-benzoylphenyl) ester Formula: C21H15NO5 MolecularWeight: 361.3475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H15NO5/c1-14-13-17(9-12-19(14)22(25)26)21(24)27-18-10-7-16(8-11-18)20(23)15-5-3-2-4-6-15/h2-13H,1H3