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Details

Stereochemistry ACHIRAL
Molecular Formula C9H9NO2
Molecular Weight 163.1736
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GENTIANIDINE

SMILES

Cc1cc2CCOC(=O)c2cn1

InChI

InChIKey=KFJQLAOTTSPBMT-UHFFFAOYSA-N
InChI=1S/C9H9NO2/c1-6-4-7-2-3-12-9(11)8(7)5-10-6/h4-5H,2-3H2,1H3

HIDE SMILES / InChI

Molecular Formula C9H9NO2
Molecular Weight 163.1736
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 Jun 26 09:47:37 UTC 2021
Edited
by admin
on Sat Jun 26 09:47:37 UTC 2021
Record UNII
35G857GZ2P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GENTIANIDINE
Common Name English
NSC-627383
Code English
6-METHYL-3,4-DIHYDRO-1H-PYRANO(3,4-C)PYRIDIN-1-ONE
Systematic Name English
NICOTINIC ACID, 4-(2-HYDROXYETHYL)-6-METHYL-, .DELTA.-LACTONE
Common Name English
1H-PYRANO(3,4-C)PYRIDIN-1-ONE, 3,4-DIHYDRO-6-METHYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
2202-12-2
Created by admin on Sat Jun 26 09:47:37 UTC 2021 , Edited by admin on Sat Jun 26 09:47:37 UTC 2021
PRIMARY
FDA UNII
35G857GZ2P
Created by admin on Sat Jun 26 09:47:37 UTC 2021 , Edited by admin on Sat Jun 26 09:47:37 UTC 2021
PRIMARY
CAS
2202-12-2
Created by admin on Sat Jun 26 09:47:37 UTC 2021 , Edited by admin on Sat Jun 26 09:47:37 UTC 2021
PRIMARY
PUBCHEM
362908
Created by admin on Sat Jun 26 09:47:37 UTC 2021 , Edited by admin on Sat Jun 26 09:47:37 UTC 2021
PRIMARY
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