[2-bromanyl-6-nitro-4-(trifluoromethyl)phenyl] 2-methylbenzoate

Systemtic Name: [2-bromanyl-6-nitro-4-(trifluoromethyl)phenyl] 2-methylbenzoate Openeye Name: [2-bromo-6-nitro-4-(trifluoromethyl)phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [2-bromo-6-nitro-4-(trifluoromethyl)phenyl] ester IUPAC Name: [2-bromo-6-nitro-4-(trifluoromethyl)phenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [2-bromo-6-nitro-4-(trifluoromethyl)phenyl] ester Formula: C15H9BrF3NO4 MolecularWeight: 404.13547

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2Br)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2Br)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H9BrF3NO4/c1-8-4-2-3-5-10(8)14(21)24-13-11(16)6-9(15(17,18)19)7-12(13)20(22)23/h2-7H,1H3