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Details

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

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

SMILES

C([C@@H]1NCCC2=CC=CC=C12)C3=CC=CC=C3

InChI

InChIKey=YRYCIFUZSUMAAY-INIZCTEOSA-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/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H17N
Molecular Weight 223.3129
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

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
6J8F3WR7LU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2,3,4-Tetrahydro-1-(phenylmethyl)isoquinoline, (S)-
Systematic Name English
J956.452G
Preferred Name English
(-)-1-Benzyl-1,2,3,4-tetrahydroisoquinoline
Systematic Name English
Isoquinoline, 1,2,3,4-tetrahydro-1-(phenylmethyl)-, (S)-
Systematic Name English
(1S)-1-Benzyl-1,2,3,4-tetrahydroisoquinoline
Systematic Name English
(1S)-1,2,3,4-Tetrahydro-1-(phenylmethyl)isoquinoline
Systematic Name English
Isoquinoline, 1,2,3,4-tetrahydro-1-(phenylmethyl)-, (1S)-
Systematic Name English
(S)-1-Benzyl-1,2,3,4-tetrahydroisoquinoline
Systematic Name English
Code System Code Type Description
CAS
57680-86-1
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
DTXSID30360922
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
6J8F3WR7LU
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
1201538
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
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