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Details

Stereochemistry ACHIRAL
Molecular Formula C15H18N2O3.2ClH.H2O
Molecular Weight 365.252
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 5-(PIPERAZIN-1-YL)BENZOFURAN-2-CARBOXYLATE DIHYDROCHLORIDE MONOHYDRATE

SMILES

O.Cl.Cl.CCOC(=O)C1=CC2=CC(=CC=C2O1)N3CCNCC3

InChI

InChIKey=GOKCUPVWRIMFNJ-UHFFFAOYSA-N
InChI=1S/C15H18N2O3.2ClH.H2O/c1-2-19-15(18)14-10-11-9-12(3-4-13(11)20-14)17-7-5-16-6-8-17;;;/h3-4,9-10,16H,2,5-8H2,1H3;2*1H;1H2

HIDE SMILES / InChI

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C15H18N2O3
Molecular Weight 274.315
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:17:20 GMT 2023
Edited
by admin
on Sat Dec 16 18:17:20 GMT 2023
Record UNII
UW5ZHQ897P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 5-(PIPERAZIN-1-YL)BENZOFURAN-2-CARBOXYLATE DIHYDROCHLORIDE MONOHYDRATE
Systematic Name English
2-BENZOFURANCARBOXYLIC ACID, 5-(1-PIPERAZINYL)-, ETHYL ESTER, HYDROCHLORIDE, HYDRATE (1:2:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
78358096
Created by admin on Sat Dec 16 18:17:20 GMT 2023 , Edited by admin on Sat Dec 16 18:17:20 GMT 2023
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FDA UNII
UW5ZHQ897P
Created by admin on Sat Dec 16 18:17:20 GMT 2023 , Edited by admin on Sat Dec 16 18:17:20 GMT 2023
PRIMARY
CAS
1422956-31-7
Created by admin on Sat Dec 16 18:17:20 GMT 2023 , Edited by admin on Sat Dec 16 18:17:20 GMT 2023
PRIMARY