Product Information
Chemical Data
Analyte Name
Cinitapride Tartrate
CAS Number
96623-56-2
Molecular Formula
C21 H30 N4 O4 . C4 H6 O6
Molecular Weight
552.57
Accurate Mass
552.2431
SMILES
CCOc1cc(N)c(cc1C(=O)NC2CCN(CC3CCC=CC3)CC2)[N+](=O)[O-].O[C@H]([C@@H](O)C(=O)O)C(=O)O
InChI
InChI=1S/C21H30N4O4.C4H6O6/c1-2-29-20-13-18(22)19(25(27)28)12-17(20)21(26)23-16-8-10-24(11-9-16)14-15-6-4-3-5-7-15;5-1(3(7)8)2(6)4(9)10/h3-4,12-13,15-16H,2,5-11,14,22H2,1H3,(H,23,26);1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1
IUPAC
4-amino-N-[1-(cyclohex-3-en-1-ylmethyl)-4-piperidyl]-2-ethoxy-5-nitro-benzamide;(2R,3R)-2,3-dihydroxybutanedioic acid
Alternate CAS Number
Free base: 66564-14-5
Product Data
Storage Temperature
+4°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
API
Product Format
Neat
API Family
Purity
>95% (HPLC)
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