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Details

Stereochemistry UNKNOWN
Molecular Formula C23H33NO3.ClH
Molecular Weight 407.974
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-METHOXYPSEUDOTROPINE PHENYLCYCLOHEXYLACETATE, HYDROCHLORIDE

SMILES

Cl.COC1C[C@H]2C[C@@H](C[C@@H]1N2C)OC(=O)C(C3CCCCC3)C4=CC=CC=C4

InChI

InChIKey=MFLAPAOGSRDTFD-GJNCZFSGSA-N
InChI=1S/C23H33NO3.ClH/c1-24-18-13-19(15-20(24)21(14-18)26-2)27-23(25)22(16-9-5-3-6-10-16)17-11-7-4-8-12-17;/h3,5-6,9-10,17-22H,4,7-8,11-15H2,1-2H3;1H/t18-,19+,20+,21?,22?;/m1./s1

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 C23H33NO3
Molecular Weight 371.513
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 3 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:36:48 GMT 2023
Edited
by admin
on Fri Dec 15 15:36:48 GMT 2023
Record UNII
LL4OP46NM6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-METHOXYPSEUDOTROPINE PHENYLCYCLOHEXYLACETATE, HYDROCHLORIDE
Systematic Name English
6-METHOXYPSEUDOTROPINE PHENYLCYCLOHEXYLACETIC ACID ESTER, HYDROCHLORIDE
Systematic Name English
BENZENEACETIC ACID, .ALPHA.-CYCLOHEXYL-, 6-METHOXY-8-METHYL-8-AZABICYCLO(3.2.1)OCT-3-YL ESTER, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
121159-75-9
Created by admin on Fri Dec 15 15:36:48 GMT 2023 , Edited by admin on Fri Dec 15 15:36:48 GMT 2023
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FDA UNII
LL4OP46NM6
Created by admin on Fri Dec 15 15:36:48 GMT 2023 , Edited by admin on Fri Dec 15 15:36:48 GMT 2023
PRIMARY
PUBCHEM
133082341
Created by admin on Fri Dec 15 15:36:48 GMT 2023 , Edited by admin on Fri Dec 15 15:36:48 GMT 2023
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