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Reference substances

Reference substances

IUPAC name:
tert-butyl N-{5-bromo-3-[(4-methylbenzenesulfonyl)oxy]pyridin-2-yl}-N-[(tert-butoxy)carbonyl]carbamate

Inventory

CAS number:
1803573-21-8
Synonyms
Names:
Identifier:
IUPAC name
2-[bis(tert-butoxycarbonyl)amino]-5-bromopyridin-3-yl 4-methylbenzenesulfonate
Identifier:
other: SMILES notation
Cc1ccc(cc1)S(=O)(=O)Oc2cc(Br)cnc2N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C
2-(bis(tert-butoxycarbonyl)amino)-5-bromopyridin-3-yl 4-methylbenzenesulfonate

Molecular and structural information

Molecular formula:
C22H27BrN2O7S
Molecular weight:
543.438
SMILES notation:
Cc1ccc(cc1)S(=O)(=O)Oc2cc(cnc2N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)Br
InChl:
InChI=1/C22H27BrN2O7S/c1-14-8-10-16(11-9-14)33(28,29)32-17-12-15(23)13-24-18(17)25(19(26)30-21(2,3)4)20(27)31-22(5,6)7/h8-13H,1-7H3
Structural formula:
Chemical structure

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