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Details

Stereochemistry UNKNOWN
Molecular Formula C18H27NO2.ClH
Molecular Weight 325.873
Optical Activity ( + )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(7-((DIMETHYLAMINO)METHYL)-4-METHOXYBICYCLO(4.2.0)OCTA-1,3,5-TRIEN-7-YL)CYCLOHEXANOL HYDROCHLORIDE, (+)-

SMILES

Cl.COC1=CC2=C(CC2(CN(C)C)C3(O)CCCCC3)C=C1

InChI

InChIKey=DZWMZTDDPDXARM-UHFFFAOYSA-N
InChI=1S/C18H27NO2.ClH/c1-19(2)13-17(18(20)9-5-4-6-10-18)12-14-7-8-15(21-3)11-16(14)17;/h7-8,11,20H,4-6,9-10,12-13H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H27NO2
Molecular Weight 289.4125
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 Sat Dec 16 18:38:53 GMT 2023
Edited
by admin
on Sat Dec 16 18:38:53 GMT 2023
Record UNII
22WTC47MLN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(7-((DIMETHYLAMINO)METHYL)-4-METHOXYBICYCLO(4.2.0)OCTA-1,3,5-TRIEN-7-YL)CYCLOHEXANOL HYDROCHLORIDE, (+)-
Systematic Name English
CYCLOHEXANOL, 1-(7-((DIMETHYLAMINO)METHYL)-4-METHOXYBICYCLO(4.2.0)OCTA-1,3,5-TRIEN-7-YL)-, HYDROCHLORIDE (1:1), (+)-
Systematic Name English
CYCLOHEXANOL, 1-(7-((DIMETHYLAMINO)METHYL)-4-METHOXYBICYCLO(4.2.0)OCTA-1,3,5-TRIEN-7-YL)-, HYDROCHLORIDE, (+)-
Systematic Name English
Code System Code Type Description
FDA UNII
22WTC47MLN
Created by admin on Sat Dec 16 18:38:53 GMT 2023 , Edited by admin on Sat Dec 16 18:38:53 GMT 2023
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CAS
242473-11-6
Created by admin on Sat Dec 16 18:38:53 GMT 2023 , Edited by admin on Sat Dec 16 18:38:53 GMT 2023
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