Analyte Name

rac Di-milnacipran-1,2-benzenedicarboxamide

Molecular Formula

C38H46N4O4

Molecular Weight

622.81

Accurate Mass

622.35

SMILES

CCN(CC)C([C@@]1(C2=CC=CC=C2)[C@H](C1)CNC(C3=C(C=CC=C3)C(NC[C@H]4[C@@](C4)(C5=CC=CC=C5)C(N(CC)CC)=O)=O)=O)=O

InChI

InChI=1S/C38H46N4O4/c1-5-41(6-2)35(45)37(27-17-11-9-12-18-27)23-29(37)25-39-33(43)31-21-15-16-22-32(31)34(44)40-26-30-24-38(30,28-19-13-10-14-20-28)36(46)42(7-3)8-4/h9-22,29-30H,5-8,23-26H2,1-4H3,(H,39,43)(H,40,44)/t29-,30+,37+,38-

IUPAC

N1-(((1R,2S)-2-(diethylcarbamoyl)-2-phenylcyclopropyl)methyl)-N2-(((1S,2R)-2-(diethylcarbamoyl)-2-phenylcyclopropyl)methyl)phthalamide

Country of Origin

CANADA

Product Format

Neat