2-[4-(Diethylamino)-2-ethoxybenzoyl]benzoic acid

HCID 15519332CAS 52830-69-0

Basic information

Standard SMILES
CCOc1cc(N(CC)CC)ccc1C(=O)c1ccccc1C(=O)O
InChIKey
CPEQFJYBWAAQLE-UHFFFAOYSA-N
Molecular formula
C20H23NO4
Average molar mass
341.4 g/mol
Monoisotopic mass
341.16270822

Names & identifiers

Preferred name
2-[4-(Diethylamino)-2-ethoxybenzoyl]benzoic acid
IUPAC
2-[4-(diethylamino)-2-ethoxybenzoyl]benzoic acid

Names & synonyms

52830-69-02-[4-(Diethylamino)-2-ethoxybenzoyl]benzoic acidbenzoic acid,2-[4-(diethylamino)-2-ethoxybenzoyl]-SCHEMBL9416209DTXSID10573573CPEQFJYBWAAQLE-UHFFFAOYSA-N2-(2-ethoxy-4-(diethylamino)benzoyl)benzoic acid2-(2-ethoxy-4-(diethylamino)benzoyl)-benzoic acid

Database identifiers

CAS
52830-69-0
PubChem CID
15519332
DTXSID
DTXSID10573573
Nikkaji
J1.543.050H

Properties

Computed structural properties

XLogP
4
Topological polar surface area
66.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
25

Related reactions

6 records

Linked notes

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