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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H19N3.C4H4O4
Molecular Weight 381.425
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ESMIRTAZAPINE MALEATE

SMILES

OC(=O)\C=C/C(O)=O.[H][C@]12CN(C)CCN1C3=C(CC4=C2C=CC=C4)C=CC=N3

InChI

InChIKey=RPUBHMMISKEXSR-MLCLTIQSSA-N
InChI=1S/C17H19N3.C4H4O4/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20;5-3(6)1-2-4(7)8/h2-8,16H,9-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t16-;/m1./s1

HIDE SMILES / InChI

Approval Year

Unknown
86413
Name Type Language
ESMIRTAZAPINE MALEATE
USAN   WHO-DD  
USAN  
Official Name English
Esmirtazapine maleate [WHO-DD]
Common Name English
(+)-(14BS)-2-METHYL-1,2,3,4,10,14B-HEXAHYDROPYRAZINO(2,1-A)PYRIDO(2,3-C)(2)BENZAZEPINE (2Z)-BUTENEDIOATE
Common Name English
ORG-50081
Code English
PYRAZINO(2,1-A)PYRIDO(2,3-C)(2)BENZAZEPINE, 1,2,3,4,10,14B-HEXAHYDRO-2-METHYL-, (14BS)-, (2Z)-2-BUTENEDIOATE (1:1)
Common Name English
ORG 50081
Code English
MIRTAZAPINE MALEATE, (S)-
Common Name English
ESMIRTAZAPINE MALEATE [USAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29756
Created by admin on Fri Dec 15 15:45:52 UTC 2023 , Edited by admin on Fri Dec 15 15:45:52 UTC 2023
Code System Code Type Description
DRUG BANK
DBSALT001294
Created by admin on Fri Dec 15 15:45:52 UTC 2023 , Edited by admin on Fri Dec 15 15:45:52 UTC 2023
PRIMARY
PUBCHEM
6451144
Created by admin on Fri Dec 15 15:45:52 UTC 2023 , Edited by admin on Fri Dec 15 15:45:52 UTC 2023
PRIMARY
ChEMBL
CHEMBL1366933
Created by admin on Fri Dec 15 15:45:52 UTC 2023 , Edited by admin on Fri Dec 15 15:45:52 UTC 2023
PRIMARY
USAN
RR-49
Created by admin on Fri Dec 15 15:45:52 UTC 2023 , Edited by admin on Fri Dec 15 15:45:52 UTC 2023
PRIMARY
CAS
680993-85-5
Created by admin on Fri Dec 15 15:45:52 UTC 2023 , Edited by admin on Fri Dec 15 15:45:52 UTC 2023
PRIMARY
NCI_THESAURUS
C76940
Created by admin on Fri Dec 15 15:45:52 UTC 2023 , Edited by admin on Fri Dec 15 15:45:52 UTC 2023
PRIMARY
SMS_ID
100000174954
Created by admin on Fri Dec 15 15:45:52 UTC 2023 , Edited by admin on Fri Dec 15 15:45:52 UTC 2023
PRIMARY
FDA UNII
I2U18E6JKA
Created by admin on Fri Dec 15 15:45:52 UTC 2023 , Edited by admin on Fri Dec 15 15:45:52 UTC 2023
PRIMARY
ACTIVE MOIETY
Structure of ESMIRTAZAPINE
PARENT (SALT/SOLVATE)
Structure of MALEIC ACID
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
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