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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H25NO
Molecular Weight 271.3972
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4-Methoxybenzyl)-2-methyl-1,2,3,4,5,6,7,8-octahydroisoquinoline, (S)-

SMILES

COC1=CC=C(C[C@@H]2N(C)CCC3=C2CCCC3)C=C1

InChI

InChIKey=CRXXSGLBECOUQH-SFHVURJKSA-N
InChI=1S/C18H25NO/c1-19-12-11-15-5-3-4-6-17(15)18(19)13-14-7-9-16(20-2)10-8-14/h7-10,18H,3-6,11-13H2,1-2H3/t18-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H25NO
Molecular Weight 271.3972
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 Wed Apr 02 20:33:19 GMT 2025
Edited
by admin
on Wed Apr 02 20:33:19 GMT 2025
Record UNII
LU4C2Z8BXC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(S)-1-(4-Methoxybenzyl)-2-methyl-1,2,3,4,5,6,7,8-octahydroisoquinoline
Preferred Name English
1-(4-Methoxybenzyl)-2-methyl-1,2,3,4,5,6,7,8-octahydroisoquinoline, (S)-
Systematic Name English
Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-1-[(4-methoxyphenyl)methyl]-2-methyl-, (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
40561868
Created by admin on Wed Apr 02 20:33:19 GMT 2025 , Edited by admin on Wed Apr 02 20:33:19 GMT 2025
PRIMARY
FDA UNII
LU4C2Z8BXC
Created by admin on Wed Apr 02 20:33:19 GMT 2025 , Edited by admin on Wed Apr 02 20:33:19 GMT 2025
PRIMARY
CAS
89614-56-2
Created by admin on Wed Apr 02 20:33:19 GMT 2025 , Edited by admin on Wed Apr 02 20:33:19 GMT 2025
PRIMARY
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