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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-methoxyphenyl)methyl]-2-methyl-1,2,3,4,5,6,7,8-octahydroisoquinoline, (R)-

SMILES

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

InChI

InChIKey=CRXXSGLBECOUQH-GOSISDBHSA-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-/m1/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 20:36:27 GMT 2025
Edited
by admin
on Wed Apr 02 20:36:27 GMT 2025
Record UNII
4WDP2N2BVZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(1R)-1-[(4-methoxyphenyl)methyl]-2-methyl-1,2,3,4,5,6,7,8-octahydroisoquinoline
Preferred Name English
1-[(4-methoxyphenyl)methyl]-2-methyl-1,2,3,4,5,6,7,8-octahydroisoquinoline, (R)-
Systematic Name English
(R)-1,2,3,4,5,6,7,8-Octahydro-1-[(4-methoxyphenyl)methyl]-2-methylisoquinoline
Systematic Name English
Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-1-[(4-methoxyphenyl)methyl]-2-methyl-, (R)-
Systematic Name English
Code System Code Type Description
CAS
67596-84-3
Created by admin on Wed Apr 02 20:36:27 GMT 2025 , Edited by admin on Wed Apr 02 20:36:27 GMT 2025
PRIMARY
PUBCHEM
21141147
Created by admin on Wed Apr 02 20:36:27 GMT 2025 , Edited by admin on Wed Apr 02 20:36:27 GMT 2025
PRIMARY
FDA UNII
4WDP2N2BVZ
Created by admin on Wed Apr 02 20:36:27 GMT 2025 , Edited by admin on Wed Apr 02 20:36:27 GMT 2025
PRIMARY
EPA CompTox
DTXSID201129687
Created by admin on Wed Apr 02 20:36:27 GMT 2025 , Edited by admin on Wed Apr 02 20:36:27 GMT 2025
PRIMARY
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