Molecular FormulaC16H18ClN3O6
Molecular Weight383.78362
InChIInChI=1S/C16H17N3O2.ClHO4/c1-3-21-16(20)15-11-19(17-18(15)2)14-10-6-8-12-7-4-5-9-13(12)14;2-1(3,4)5/h4-11,17H,3H2,1-2H3;(H,2,3,4,5)
InChIKey RAGDJRAOZMJXAL-UHFFFAOYSA-N
Smiles[NH+]1(C2=C3C(C=CC=C3)=CC=C2)C=C(C(OCC)=O)N(C)N1.Cl(=O)([O-])(=O)=O
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Spectral Code: IR : nujol mull