[4-[3,5-bis(methoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridin-4-yl]phenyl]-butyl-dimethylazanium iodide

CAS: 66941-31-9

Molecular Formula	`C23H33IN2O4`
Molecular Weight	528.4 g/mol
Topological Polar Surface Area	64.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	9
Exact Mass	528.1485
Heavy Atoms	30
Complexity	647.0

Chemical Identifiers

CAS Number	66941-31-9
SMILES	`CCCC[N+](C)(C)C1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)OC)C)C)C(=O)OC.[I-]`
InChIKey	`ASABOMCYDRXYEW-UHFFFAOYSA-N`

📖 Product Overview

[4-[3,5-bis(methoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridin-4-yl]phenyl]-butyl-dimethylazanium iodide (CAS: 66941-31-9) is a chemical compound with molecular formula C23H33IN2O4 and molecular weight 528.4 g/mol. Its IUPAC systematic name is [4-[3,5-bis(methoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridin-4-yl]phenyl]-butyl-dimethylazanium iodide. Topological Polar Surface Area 64.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 9 Exact Mass 528.1485 Heavy Atoms 30 Complexity 647.0 InChI Key: ASABOMCYDRXYEW-UHFFFAOYSA-N. SMILES: CCCC[N+](C)(C)C1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)OC)C)C)C(=O)OC.[I-].

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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for [4-[3,5-bis(methoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridin-4-yl]phenyl]-butyl-dimethylazanium iodide.

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