[2-nitro-4-(trifluoromethyl)phenyl] 4-(4-propylphenyl)benzoate

Systemtic Name: [2-nitro-4-(trifluoromethyl)phenyl] 4-(4-propylphenyl)benzoate Openeye Name: [2-nitro-4-(trifluoromethyl)phenyl] 4-(4-propylphenyl)benzoate CAS Name: 4-(4-propylphenyl)benzoic acid [2-nitro-4-(trifluoromethyl)phenyl] ester IUPAC Name: [2-nitro-4-(trifluoromethyl)phenyl] 4-(4-propylphenyl)benzoate Traditional Name: 4-(4-propylphenyl)benzoic acid [2-nitro-4-(trifluoromethyl)phenyl] ester Formula: C23H18F3NO4 MolecularWeight: 429.38853

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C23H18F3NO4/c1-2-3-15-4-6-16(7-5-15)17-8-10-18(11-9-17)22(28)31-21-13-12-19(23(24,25)26)14-20(21)27(29)30/h4-14H,2-3H2,1H3