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N,N-bis(2-hydroxyethyl)-4-[[2-(2-naphthalenyloxy)ethyl]oxy]-alpha-oxobenzeneacetamide

HCID 19004530
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(C(=O)N(CCO)CCO)c1ccc(OCCOc2ccc3ccccc3c2)cc1
InChIKey
IYOCQMHWKPFTRW-UHFFFAOYSA-N
Molecular formula
C24H25NO6
Average molar mass
423.5 g/mol
Monoisotopic mass
423.16818752

Names & identifiers

Preferred name
N,N-bis(2-hydroxyethyl)-4-[[2-(2-naphthalenyloxy)ethyl]oxy]-alpha-oxobenzeneacetamide
IUPAC
N,N-bis(2-hydroxyethyl)-2-[4-(2-naphthalen-2-yloxyethoxy)phenyl]-2-oxoacetamide

Names & synonyms

SCHEMBL9043733IYOCQMHWKPFTRW-UHFFFAOYSA-NN,N-bis(2-hydroxyethyl)-4-[[2-(2-naphthalenyloxy)ethyl]oxy]-alpha-oxobenzeneacetamide

Database identifiers

PubChem CID
19004530

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
96.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
31
Formal charge
0
Complexity
556

Related reactions

2 records
New reaction record
HRID 662446 reaction equation
HRID 662446As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 2225758 reaction equation
HRID 2225758As productuspto-grants-1994_09

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes