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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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