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Details

Stereochemistry RACEMIC
Molecular Formula C11H15ClN2O2.ClH
Molecular Weight 279.163
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2-CHLOROETHYL)-2-METHYL-9-HYDROXY-6,7,8,9-TETRAHYDRO-4H-PYRIDO (1,2-A) PYRIMIDIN-4-ONE HYDROCHLORIDE

SMILES

Cl.CC1=C(CCCl)C(=O)N2CCCC(O)C2=N1

InChI

InChIKey=YZWXZANAEMMNAW-UHFFFAOYSA-N
InChI=1S/C11H15ClN2O2.ClH/c1-7-8(4-5-12)11(16)14-6-2-3-9(15)10(14)13-7;/h9,15H,2-6H2,1H3;1H

HIDE SMILES / InChI

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

Molecular Formula C11H15ClN2O2
Molecular Weight 242.702
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:16:25 GMT 2023
Edited
by admin
on Sat Dec 16 15:16:25 GMT 2023
Record UNII
7C3ZON4VNI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(2-CHLOROETHYL)-2-METHYL-9-HYDROXY-6,7,8,9-TETRAHYDRO-4H-PYRIDO (1,2-A) PYRIMIDIN-4-ONE HYDROCHLORIDE
Systematic Name English
4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE, 3-(2-CHLOROETHYL)-6,7,8,9-TETRAHYDRO-9-HYDROXY-2-METHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
49766142
Created by admin on Sat Dec 16 15:16:25 GMT 2023 , Edited by admin on Sat Dec 16 15:16:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID30678514
Created by admin on Sat Dec 16 15:16:25 GMT 2023 , Edited by admin on Sat Dec 16 15:16:25 GMT 2023
PRIMARY
FDA UNII
7C3ZON4VNI
Created by admin on Sat Dec 16 15:16:25 GMT 2023 , Edited by admin on Sat Dec 16 15:16:25 GMT 2023
PRIMARY
CAS
849727-63-5
Created by admin on Sat Dec 16 15:16:25 GMT 2023 , Edited by admin on Sat Dec 16 15:16:25 GMT 2023
PRIMARY