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Details

Stereochemistry RACEMIC
Molecular Formula C10H11NO2
Molecular Weight 177.1998
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID

SMILES

OC(=O)C1CC2=CC=CC=C2CN1

InChI

InChIKey=BWKMGYQJPOAASG-UHFFFAOYSA-N
InChI=1S/C10H11NO2/c12-10(13)9-5-7-3-1-2-4-8(7)6-11-9/h1-4,9,11H,5-6H2,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C10H11NO2
Molecular Weight 177.1998
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 15:13:56 GMT 2023
Edited
by admin
on Sat Dec 16 15:13:56 GMT 2023
Record UNII
C0KDL86B2L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID
Systematic Name English
1,2,3,4-TETRAHYDRO-3-ISOQUINOLINECARBOXYLIC ACID
Systematic Name English
3-ISOQUINOLINECARBOXYLIC ACID, 1,2,3,4-TETRAHYDRO-
Systematic Name English
DL-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC
Systematic Name English
1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID, (±)-
Common Name English
Code System Code Type Description
PUBCHEM
95489
Created by admin on Sat Dec 16 15:13:56 GMT 2023 , Edited by admin on Sat Dec 16 15:13:56 GMT 2023
PRIMARY
CAS
67123-97-1
Created by admin on Sat Dec 16 15:13:56 GMT 2023 , Edited by admin on Sat Dec 16 15:13:56 GMT 2023
PRIMARY
FDA UNII
C0KDL86B2L
Created by admin on Sat Dec 16 15:13:56 GMT 2023 , Edited by admin on Sat Dec 16 15:13:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID80868286
Created by admin on Sat Dec 16 15:13:56 GMT 2023 , Edited by admin on Sat Dec 16 15:13:56 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT