[4-[bis(2-bromoethyl)amino]phenyl] 3-(trifluoromethyl)benzoate

Systemtic Name: [4-[bis(2-bromoethyl)amino]phenyl] 3-(trifluoromethyl)benzoate Openeye Name: [4-[bis(2-bromoethyl)amino]phenyl] 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid [4-[bis(2-bromoethyl)amino]phenyl] ester IUPAC Name: [4-[bis(2-bromoethyl)amino]phenyl] 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid [4-[bis(2-bromoethyl)amino]phenyl] ester Formula: C18H16Br2F3NO2 MolecularWeight: 495.12835

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C(=O)OC2=CC=C(C=C2)N(CCBr)CCBr

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C(=O)OC2=CC=C(C=C2)N(CCBr)CCBr

InChI

InChI=1S/C18H16Br2F3NO2/c19-8-10-24(11-9-20)15-4-6-16(7-5-15)26-17(25)13-2-1-3-14(12-13)18(21,22)23/h1-7,12H,8-11H2