Analyte Name

(Z)-but-2-enedioic acid N-((4-(2-cyanophenyl)piperazin-1-yl)methyl)-3-methylbenzamide

CAS Number

630117-19-0

Molecular Formula

C20 H22 N4 O . C4 H4 O4

Molecular Weight

450.487

Accurate Mass

450.19

SMILES

Cc1cccc(c1)C(=O)NCN2CCN(CC2)c3ccccc3C#N.OC(=O)\C=C/C(=O)O

InChI

InChI=1S/C20H22N4O.C4H4O4/c1-16-5-4-7-17(13-16)20(25)22-15-23-9-11-24(12-10-23)19-8-3-2-6-18(19)14-21;5-3(6)1-2-4(7)8/h2-8,13H,9-12,15H2,1H3,(H,22,25);1-2H,(H,5,6)(H,7,8)/b;2-1-

IUPAC

(Z)-but-2-enedioic acid;N-[[4-(2-cyanophenyl)piperazin-1-yl]methyl]-3-methylbenzamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat