tert-butyl 3-(bromomethyl)-2,4-bis(chloranyl)-5-(iodanylamino)benzoate

Systemtic Name: tert-butyl 3-(bromomethyl)-2,4-bis(chloranyl)-5-(iodanylamino)benzoate Openeye Name: tert-butyl 3-(bromomethyl)-2,4-dichloro-5-(iodoamino)benzoate CAS Name: 3-(bromomethyl)-2,4-dichloro-5-(iodoamino)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(bromomethyl)-2,4-dichloro-5-(iodoamino)benzoate Traditional Name: 3-(bromomethyl)-2,4-dichloro-5-(iodoamino)benzoic acid tert-butyl ester Formula: C12H13BrCl2INO2 MolecularWeight: 480.95159

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C(=C1Cl)CBr)Cl)NI

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C(=C1Cl)CBr)Cl)NI

InChI

InChI=1S/C12H13BrCl2INO2/c1-12(2,3)19-11(18)6-4-8(17-16)10(15)7(5-13)9(6)14/h4,17H,5H2,1-3H3