Propanoic acid, 2-(4-((7-chloro-2-quinoxalinyl)oxy)phenoxy)-, methyl ester

HCID 157156

Completing data — usually done within a minute

Basic information

CAS
78104-71-9
Standard SMILES
COC(=O)C(C)Oc1ccc(Oc2cnc3ccc(Cl)cc3n2)cc1
InChIKey
NPUWJNOFOGQLSR-UHFFFAOYSA-N
Molecular formula
C18H15ClN2O4
Average molar mass
358.8 g/mol
Monoisotopic mass
358.07203464

Names & identifiers

Preferred name
Propanoic acid, 2-(4-((7-chloro-2-quinoxalinyl)oxy)phenoxy)-, methyl ester
IUPAC
methyl 2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanoate

Names & synonyms

78104-71-9Propanoic acid, 2-(4-((7-chloro-2-quinoxalinyl)oxy)phenoxy)-, methyl esterPropanoic acid, 2-[4-[(7-chloro-2-quinoxalinyl)oxy]phenoxy]-, methyl esterXB-947CHEMBL300003SCHEMBL8880041NPUWJNOFOGQLSR-UHFFFAOYSA-NDTXSID001358503METHYL 2-{4-[(7-CHLOROQUINOXALIN-2-YL)OXY]PHENOXY}PROPANOATEDA-21103methyl 2-[4-(7-chloro-2-quinoxalinyloxy)phenoxy]propionateRacemic Methyl 2-[4-(7-chloroquinoxalinyloxy)phenoxy]propionate

Database identifiers

CAS
78104-71-9
PubChem CID
157156
DTXSID
DTXSID001358503
ChEMBL
CHEMBL300003
Nikkaji
J1.262.245G

Properties

Computed structural propertiesFilling in

XLogP
3.9
Topological polar surface area
70.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
25

Related reactions

3 records

Compound notes

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