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Details

Stereochemistry ABSOLUTE
Molecular Formula C34H51NO4.ClH
Molecular Weight 574.234
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DODECANOIC ACID 5(R)-(2-(2-(2-(3-METHOXYPHENYL)ETHYL)PHENOXY)ETHYL)PYRROLIDIN-3(R)-YL ESTER HYDROCHLORIDE

SMILES

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

InChI

InChIKey=ZERKGTSTTNKAPA-UNCJQMLCSA-N
InChI=1S/C34H51NO4.ClH/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;1H/t30-,32-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DODECANOIC ACID 5(R)-(2-(2-(2-(3-METHOXYPHENYL)ETHYL)PHENOXY)ETHYL)PYRROLIDIN-3(R)-YL ESTER HYDROCHLORIDE
Systematic Name English
(-)-R-102444
Common Name English
DODECANOIC ACID, (3R,5R)-5-(2-(2-(2-(3-METHOXYPHENYL)ETHYL)PHENOXY)ETHYL)-1-METHYL-3-PYRROLIDINYL ESTER, HYDROCHLORIDE
Systematic Name English
DODECANOIC ACID, 5-(2-(2-(2-(3-METHOXYPHENYL)ETHYL)PHENOXY)ETHYL)-1-METHYL-3-PYRROLIDINYL ESTER, HYDROCHLORIDE, (3R-TRANS)-
Systematic Name English
R-102444
Common Name English
DODECANOIC ACID, (3R,5R)-5-(2-(2-(2-(3-METHOXYPHENYL)ETHYL)PHENOXY)ETHYL)-1-METHYL-3-PYRROLIDINYL ESTER, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
191090-74-1
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
10745694
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
AF25B3HNV9
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