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Details

Stereochemistry RACEMIC
Molecular Formula C21H35N3O4.C3H6O3
Molecular Weight 483.5982
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-ETHYLHEXYL ((3-((2-(DIMETHYLAMINO)ETHOXY)CARBONYL)AMINO)-4-METHYLPHENYL)CARBAMATE LACTATE

SMILES

CC(O)C(O)=O.CCCCC(CC)COC(=O)NC1=CC=C(C)C(NC(=O)OCCN(C)C)=C1

InChI

InChIKey=HYNJGJWCXRMUIG-UHFFFAOYSA-N
InChI=1S/C21H35N3O4.C3H6O3/c1-6-8-9-17(7-2)15-28-20(25)22-18-11-10-16(3)19(14-18)23-21(26)27-13-12-24(4)5;1-2(4)3(5)6/h10-11,14,17H,6-9,12-13,15H2,1-5H3,(H,22,25)(H,23,26);2,4H,1H3,(H,5,6)

HIDE SMILES / InChI

Approval Year

Name Type Language
2-ETHYLHEXYL ((3-((2-(DIMETHYLAMINO)ETHOXY)CARBONYL)AMINO)-4-METHYLPHENYL)CARBAMATE LACTATE
Common Name English
CARBAMIC ACID, ((3-((2-(DIMETHYLAMINO)ETHOXY)CARBONYL)AMINO)-4-METHYLPHENYL)-, 2-ETHYLHEXYL ESTER, MONO(2-HYDROXYPROPANOATE)
Systematic Name English
2-ETHYLHEXYL ((3-((2-(DIMETHYLAMINO)ETHOXY)CARBONYL)AMINO)-4-METHYLPHENYL)CARBAMATE, 2-HYDROXY-PROPANOIC ACID SALT
Common Name English
PROPANOIC ACID, 2-HYDROXY-, COMPD. WITH 2-ETHYLHEXYL ((3-((2-(DIMETHYLAMINO)ETHOXY)CARBONYL)AMINO)-4-METHYLPHENYL)CARBAMATE (1:1)
Common Name English
Code System Code Type Description
FDA UNII
4CK3ML80P7
Created by admin on Sat Dec 16 10:42:59 GMT 2023 , Edited by admin on Sat Dec 16 10:42:59 GMT 2023
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EPA CompTox
DTXSID3028421
Created by admin on Sat Dec 16 10:42:59 GMT 2023 , Edited by admin on Sat Dec 16 10:42:59 GMT 2023
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CAS
68227-46-3
Created by admin on Sat Dec 16 10:42:59 GMT 2023 , Edited by admin on Sat Dec 16 10:42:59 GMT 2023
PRIMARY
PUBCHEM
6437503
Created by admin on Sat Dec 16 10:42:59 GMT 2023 , Edited by admin on Sat Dec 16 10:42:59 GMT 2023
PRIMARY
ECHA (EC/EINECS)
269-358-5
Created by admin on Sat Dec 16 10:42:59 GMT 2023 , Edited by admin on Sat Dec 16 10:42:59 GMT 2023
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