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Details

Stereochemistry RACEMIC
Molecular Formula C17H21N3O
Molecular Weight 283.3681
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACYCLOMIRTAZAPINE ALCOHOL

SMILES

CN1CCN(C(C1)C2=CC=CC=C2)C3=C(CO)C=CC=N3

InChI

InChIKey=PYZPABZGIRHQTA-UHFFFAOYSA-N
InChI=1S/C17H21N3O/c1-19-10-11-20(17-15(13-21)8-5-9-18-17)16(12-19)14-6-3-2-4-7-14/h2-9,16,21H,10-13H2,1H3

HIDE SMILES / InChI
Molecular Formula C17H21N3O
Molecular Weight 283.3681
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Unknown
139594
Substance Class Chemical
Created
by admin
on Sat Dec 16 11:27:51 GMT 2023
Edited
by admin
on Sat Dec 16 11:27:51 GMT 2023
Record UNII
XRO2GE880O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACYCLOMIRTAZAPINE ALCOHOL
Common Name English
MIRTAZAPINE IMPURITY B [EP IMPURITY]
Common Name English
1-(3-HYDROXYMETHYLPYRIDIN-2-YL)-4-METHYL-2-PHENYLPIPERAZINE
Systematic Name English
1-(3-(HYDROXYMETHYL)PYRIDIN-2-YL)-4-METHYL-2-PHENYLPIPERAZINE
Common Name English
1-(3-HYDROXYMETHYL-2-PYRIDYL)-4-METHYL-2-PHENYLPIPERAZINE
Common Name English
3-PYRIDINEMETHANOL, 2-(4-METHYL-2-PHENYL-1-PIPERAZINYL)-
Systematic Name English
2-(4-METHYL-2-PHENYL-1-PIPERAZINYL)-3-PYRIDINEMETHANOL
Common Name English
2-(4-METHYL-2-PHENYLPIPERAZIN-1-YL)PYRIDINE-3-METHANOL
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID901036336
Created by admin on Sat Dec 16 11:27:51 GMT 2023 , Edited by admin on Sat Dec 16 11:27:51 GMT 2023
PRIMARY
CAS
61337-89-1
Created by admin on Sat Dec 16 11:27:51 GMT 2023 , Edited by admin on Sat Dec 16 11:27:51 GMT 2023
PRIMARY
PUBCHEM
10221435
Created by admin on Sat Dec 16 11:27:51 GMT 2023 , Edited by admin on Sat Dec 16 11:27:51 GMT 2023
PRIMARY
FDA UNII
XRO2GE880O
Created by admin on Sat Dec 16 11:27:51 GMT 2023 , Edited by admin on Sat Dec 16 11:27:51 GMT 2023
PRIMARY
Related Record Type Details
Structure of MIRTAZAPINE
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of MIRTAZAPINE
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
NIH
NCATS
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