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Details

Stereochemistry RACEMIC
Molecular Formula C18H25NO
Molecular Weight 271.3972
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4-Methoxy-benzyl)-2-methyl-1,2,3,4,5,6,7,8-octahydro-isoquinoline

SMILES

COC1=CC=C(CC2N(C)CCC3=C2CCCC3)C=C1

InChI

InChIKey=CRXXSGLBECOUQH-UHFFFAOYSA-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

HIDE SMILES / InChI

Molecular Formula C18H25NO
Molecular Weight 271.3972
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 Wed Apr 02 18:46:48 GMT 2025
Edited
by admin
on Wed Apr 02 18:46:48 GMT 2025
Record UNII
22KF2P6KQA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2,3,4,5,6,7,8-Octahydro-1-[(4-methoxyphenyl)methyl]-2-methylisoquinoline
Preferred Name English
1-(4-Methoxy-benzyl)-2-methyl-1,2,3,4,5,6,7,8-octahydro-isoquinoline
Systematic Name English
Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-1-(p-methoxybenzyl)-2-methyl-, (±)-
Systematic Name English
Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-1-[(4-methoxyphenyl)methyl]-2-methyl-
Systematic Name English
Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-1-p-methoxybenzyl-2-methyl-, dl-
Systematic Name English
Code System Code Type Description
CAS
38969-65-2
Created by admin on Wed Apr 02 18:46:48 GMT 2025 , Edited by admin on Wed Apr 02 18:46:48 GMT 2025
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FDA UNII
22KF2P6KQA
Created by admin on Wed Apr 02 18:46:48 GMT 2025 , Edited by admin on Wed Apr 02 18:46:48 GMT 2025
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EPA CompTox
DTXSID70959819
Created by admin on Wed Apr 02 18:46:48 GMT 2025 , Edited by admin on Wed Apr 02 18:46:48 GMT 2025
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PUBCHEM
356228
Created by admin on Wed Apr 02 18:46:48 GMT 2025 , Edited by admin on Wed Apr 02 18:46:48 GMT 2025
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