ethyl 1-methyl-5-(4-methylphenyl)sulfonyloxy-2-(morpholin-4-ium-4-ylmethyl)indole-3-carboxylate chloride

CAS: 88461-82-9

Molecular Formula	`C24H29ClN2O6S`
Molecular Weight	509.0 g/mol
Topological Polar Surface Area	96.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	508.1435
Heavy Atoms	34
Complexity	757.0

Chemical Identifiers

CAS Number	88461-82-9
SMILES	`CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C)C[NH+]4CCOCC4.[Cl-]`
InChIKey	`CRQSDZTWINWANB-UHFFFAOYSA-N`

📖 Product Overview

ethyl 1-methyl-5-(4-methylphenyl)sulfonyloxy-2-(morpholin-4-ium-4-ylmethyl)indole-3-carboxylate chloride (CAS: 88461-82-9) is a chemical compound with molecular formula C24H29ClN2O6S and molecular weight 509.0 g/mol. Its IUPAC systematic name is ethyl 1-methyl-5-(4-methylphenyl)sulfonyloxy-2-(morpholin-4-ium-4-ylmethyl)indole-3-carboxylate chloride. Topological Polar Surface Area 96.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 8 Exact Mass 508.1435 Heavy Atoms 34 Complexity 757.0 InChI Key: CRQSDZTWINWANB-UHFFFAOYSA-N. SMILES: CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C)C[NH+]4CCOCC4.[Cl-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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Technical Blog Article

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