2-[[Acetyl[4-(tetradecyloxy)benzoyl]amino]methyl]-1-methylpyridinium iodide

HCID 9851822
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Basic information

Standard SMILES
CCCCCCCCCCCCCCOc1ccc(C(=O)N(Cc2cccc[n+]2C)C(C)=O)cc1.[I-]
InChIKey
LEXXOCXMBVMUNG-UHFFFAOYSA-M
Molecular formula
C30H45IN2O3
Average molar mass
608.6 g/mol

Names & identifiers

Preferred name
2-[[Acetyl[4-(tetradecyloxy)benzoyl]amino]methyl]-1-methylpyridinium iodide
IUPAC
N-acetyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-tetradecoxybenzamide iodide

Names & synonyms

CHEMBL154205SCHEMBL9308068LEXXOCXMBVMUNG-UHFFFAOYSA-M2-[[Acetyl[4-(tetradecyloxy)benzoyl]amino]methyl]-1-methylpyridinium iodide

Database identifiers

PubChem CID
9851822
ChEMBL
CHEMBL154205

Properties

Computed structural properties

Topological polar surface area
50.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
17
Heavy atoms
36

Related reactions

2 records
New reaction record

Compound notes

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