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

Systemtic Name: [4-(4-methylphenyl)phenyl] 4-methyl-3-nitro-benzoate Openeye Name: [4-(p-tolyl)phenyl] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [4-(4-methylphenyl)phenyl] ester IUPAC Name: [4-(4-methylphenyl)phenyl] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [4-(p-tolyl)phenyl] ester Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17NO4/c1-14-3-6-16(7-4-14)17-9-11-19(12-10-17)26-21(23)18-8-5-15(2)20(13-18)22(24)25/h3-13H,1-2H3