[2-nitro-4-(trifluoromethyl)phenyl] 2-methylbenzoate

Systemtic Name: [2-nitro-4-(trifluoromethyl)phenyl] 2-methylbenzoate Openeye Name: [2-nitro-4-(trifluoromethyl)phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [2-nitro-4-(trifluoromethyl)phenyl] ester IUPAC Name: [2-nitro-4-(trifluoromethyl)phenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [2-nitro-4-(trifluoromethyl)phenyl] ester Formula: C15H10F3NO4 MolecularWeight: 325.23941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H10F3NO4/c1-9-4-2-3-5-11(9)14(20)23-13-7-6-10(15(16,17)18)8-12(13)19(21)22/h2-8H,1H3