tert-butyl 4-[bis(2-bromoethyl)amino]-3,5-bis(fluoranyl)benzoate

Systemtic Name: tert-butyl 4-[bis(2-bromoethyl)amino]-3,5-bis(fluoranyl)benzoate Openeye Name: tert-butyl 4-[bis(2-bromoethyl)amino]-3,5-difluoro-benzoate CAS Name: 4-[bis(2-bromoethyl)amino]-3,5-difluorobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[bis(2-bromoethyl)amino]-3,5-difluorobenzoate Traditional Name: 4-[bis(2-bromoethyl)amino]-3,5-difluoro-benzoic acid tert-butyl ester Formula: C15H19Br2F2NO2 MolecularWeight: 443.121666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)F)N(CCBr)CCBr)F

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)F)N(CCBr)CCBr)F

InChI

InChI=1S/C15H19Br2F2NO2/c1-15(2,3)22-14(21)10-8-11(18)13(12(19)9-10)20(6-4-16)7-5-17/h8-9H,4-7H2,1-3H3