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Product Overview

Product Code

TRC-C496400

CAS Number

81098-60-4

Product Format

Neat

Molecular Formula

C23 H29 Cl F N3 O4

Molecular Weight

465.95

API Family

Cisapride Monohydrate

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

API

Documentation

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Product Information

Chemical Data

Analyte Name

Cisapride

CAS Number

81098-60-4

Molecular Formula

C23 H29 Cl F N3 O4

Molecular Weight

465.95

Accurate Mass

465.1831

SMILES

CO[C@@H]1CN(CCCOc2ccc(F)cc2)CC[C@@H]1NC(=O)c3cc(Cl)c(N)cc3OC

InChI

InChI=1S/C23H29ClFN3O4/c1-30-21-13-19(26)18(24)12-17(21)23(29)27-20-8-10-28(14-22(20)31-2)9-3-11-32-16-6-4-15(25)5-7-16/h4-7,12-13,20,22H,3,8-11,14,26H2,1-2H3,(H,27,29)/t20-,22+/m0/s1

IUPAC

4-amino-5-chloro-N-[(3R,4S)-1-[3-(4-fluorophenoxy)propyl]-3-methoxypiperidin-4-yl]-2-methoxybenzamide

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Cisapride Monohydrate

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