U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C16H17N
Molecular Weight 223.3129
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,3,4-Tetrahydro-1-(phenylmethyl)isoquinoline

SMILES

C(C1NCCC2=CC=CC=C12)C3=CC=CC=C3

InChI

InChIKey=YRYCIFUZSUMAAY-UHFFFAOYSA-N
InChI=1S/C16H17N/c1-2-6-13(7-3-1)12-16-15-9-5-4-8-14(15)10-11-17-16/h1-9,16-17H,10-12H2

HIDE SMILES / InChI

Molecular Formula C16H17N
Molecular Weight 223.3129
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 Tue Apr 01 17:49:21 GMT 2025
Edited
by admin
on Tue Apr 01 17:49:21 GMT 2025
Record UNII
X4S06GK4KN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2,3,4-Tetrahydro-1-(phenylmethyl)isoquinoline
Systematic Name English
AR-R 15209
Preferred Name English
NSC-140739
Code English
J432.285A
Code English
1BNTIQ
Common Name English
1-BENZYL-1,2,3,4-TETRAHYDROISOQUINOLINE
Systematic Name English
ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-1-(PHENYLMETHYL)-
Systematic Name English
ISOQUINOLINE, 1-BENZYL-1,2,3,4-TETRAHYDRO-
Systematic Name English
Code System Code Type Description
NSC
140739
Created by admin on Tue Apr 01 17:49:21 GMT 2025 , Edited by admin on Tue Apr 01 17:49:21 GMT 2025
PRIMARY
EPA CompTox
DTXSID70864898
Created by admin on Tue Apr 01 17:49:21 GMT 2025 , Edited by admin on Tue Apr 01 17:49:21 GMT 2025
PRIMARY
CHEBI
16804
Created by admin on Tue Apr 01 17:49:21 GMT 2025 , Edited by admin on Tue Apr 01 17:49:21 GMT 2025
PRIMARY
PUBCHEM
98468
Created by admin on Tue Apr 01 17:49:21 GMT 2025 , Edited by admin on Tue Apr 01 17:49:21 GMT 2025
PRIMARY
CAS
19716-56-4
Created by admin on Tue Apr 01 17:49:21 GMT 2025 , Edited by admin on Tue Apr 01 17:49:21 GMT 2025
PRIMARY
FDA UNII
X4S06GK4KN
Created by admin on Tue Apr 01 17:49:21 GMT 2025 , Edited by admin on Tue Apr 01 17:49:21 GMT 2025
PRIMARY