Derivatization Reagents

Cas#: 948995-62-8        Compound CID:  17751994

Formula:  C₂₃H₂₂N₂O₈        Molecular Weight: 454.44

IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-4-oxobutanoate

SMILES: CC1=CC(=CC(=C1OCC2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)CCC(=O)ON3C(=O)CCC3=O

InChIKey: CUTCHWUKZOOSRX-UHFFFAOYSA-N

InChI: InChI=1S/C23H22N2O8/c1-14-11-17(19(26)7-10-22(29)33-24-20(27)8-9-21(24)28)12-15(2)23(14)32-13-16-3-5-18(6-4-16)25(30)31/h3-6,11-12H,7-10,13H2,1-2H3

Cas#: 54455-34-4       

Formula:  C₉H₅ClN₂O₄        Molecular Weight: 240.6

IUPAC Name: 2-(chloromethyl)-5-nitroisoindole-1,3-dione

SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CCl

InChIKey: YXMUGXUCSVUONH-UHFFFAOYSA-N

InChI: InChI=1S/C9H5ClN2O4/c10-4-11-8(13)6-2-1-5(12(15)16)3-7(6)9(11)14/h1-3H,4H2

Cas#: 140164-85-8       

Formula:  C₉H₇ClN₄O₄        Molecular Weight: 270.63

IUPAC Name: 2-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]acetyl chloride

SMILES: CN(CC(=O)Cl)C1=CC=C(C2=NON=C12)[N+](=O)[O-]

InChIKey: BLKGIXBLRWZLKS-UHFFFAOYSA-N

InChI: InChI=1S/C9H7ClN4O4/c1-13(4-7(10)15)5-2-3-6(14(16)17)9-8(5)11-18-12-9/h2-3H,4H2,1H3

Cas#: 124522-09-4       

Formula:  C₁₀H₈BrNO₃        Molecular Weight: 270.08

IUPAC Name: 3-(bromomethyl)-7-methoxy-1,4-benzoxazin-2-one

SMILES: COC1=CC2=C(C=C1)N=C(C(=O)O2)CBr

InChIKey: XFCZURAACWKKIH-UHFFFAOYSA-N

InChI: InChI=1S/C10H8BrNO3/c1-14-6-2-3-7-9(4-6)15-10(13)8(5-11)12-7/h2-4H,5H2,1H3