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Details

Stereochemistry ABSOLUTE
Molecular Formula C34H51NO4
Molecular Weight 537.773
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIARYLALKANE DERIVATIVE 1

SMILES

CCCCCCCCCCCC(=O)O[C@@H]1C[C@@H](CCOC2=CC=CC=C2CCC3=CC=CC(OC)=C3)N(C)C1

InChI

InChIKey=ZVCROHONSVCKKH-XLJNKUFUSA-N
InChI=1S/C34H51NO4/c1-4-5-6-7-8-9-10-11-12-20-34(36)39-32-26-30(35(2)27-32)23-24-38-33-19-14-13-17-29(33)22-21-28-16-15-18-31(25-28)37-3/h13-19,25,30,32H,4-12,20-24,26-27H2,1-3H3/t30-,32-/m1/s1

HIDE SMILES / InChI

Molecular Formula C34H51NO4
Molecular Weight 537.773
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:08:54 GMT 2023
Edited
by admin
on Sat Dec 16 09:08:54 GMT 2023
Record UNII
MSQ4Y6W7VA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIARYLALKANE DERIVATIVE 1
Common Name English
(3R,5R)-5-(2-(2-(2-(3-METHOXYPHENYL)ETHYL)PHENOXY)ETHYL)-1-METHYL-3-PYRROLIDINYL DODECANOATE
Systematic Name English
DODECANOIC ACID, 5-(2-(2-(2-(3-METHOXYPHENYL)ETHYL)PHENOXY)ETHYL)-1-METHYL-3-PYRROLIDINYL ESTER, (3R-TRANS)-
Systematic Name English
DODECANOIC ACID, (3R,5R)-5-(2-(2-(2-(3-METHOXYPHENYL)ETHYL)PHENOXY)ETHYL)-1-METHYL-3-PYRROLIDINYL ESTER
Systematic Name English
R-102444 FREE BASE
Common Name English
Code System Code Type Description
CAS
191155-65-4
Created by admin on Sat Dec 16 09:08:54 GMT 2023 , Edited by admin on Sat Dec 16 09:08:54 GMT 2023
PRIMARY
FDA UNII
MSQ4Y6W7VA
Created by admin on Sat Dec 16 09:08:54 GMT 2023 , Edited by admin on Sat Dec 16 09:08:54 GMT 2023
PRIMARY
PUBCHEM
10256696
Created by admin on Sat Dec 16 09:08:54 GMT 2023 , Edited by admin on Sat Dec 16 09:08:54 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY