Rupatadine Fumarate - Impurity A
Product Code
TRC-R701658-250MG
CAS Number
Product Format
Neat
Molecular Formula
C30 H30 Cl N3 O4
Molecular Weight
532.03
Product Categories
Price and availability
Product Information
Product Data
Analyte Name
3-[(4-(8-Chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidin-1-yl)methyl]-1-(1,2-dicarboxyethyl)-5-methylpyridin-1-ium Inner Salt
CAS Number
1354055-68-7
Molecular Formula
C30 H30 Cl N3 O4
Molecular Weight
532.03
Accurate Mass
531.1925
SMILES
Cc1cc(CN2CCC(=C3c4ccc(Cl)cc4CCc5cccnc35)CC2)c[n+](c1)C(CC(=O)O)C(=O)[O-]
InChI
InChI=1S/C30H30ClN3O4/c1-19-13-20(18-34(16-19)26(30(37)38)15-27(35)36)17-33-11-8-21(9-12-33)28-25-7-6-24(31)14-23(25)5-4-22-3-2-10-32-29(22)28/h2-3,6-7,10,13-14,16,18,26H,4-5,8-9,11-12,15,17H2,1H3,(H-,35,36,37,38)
IUPAC
3-[(4-(8-Chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidin-1-yl)methyl]-1-(1,2-dicarboxyethyl)-5-methylpyridin-1-ium Inner Salt
Storage & Transport Information
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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