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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H14N2O
Molecular Weight 166.2203
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ABT-418, (R)-

SMILES

CN1CCC[C@@H]1C2=CC(C)=NO2

InChI

InChIKey=ILLGYRJAYAAAEW-MRVPVSSYSA-N
InChI=1S/C9H14N2O/c1-7-6-9(12-10-7)8-4-3-5-11(8)2/h6,8H,3-5H2,1-2H3/t8-/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H14N2O
Molecular Weight 166.2203
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:16:28 GMT 2023
Edited
by admin
on Sat Dec 16 09:16:28 GMT 2023
Record UNII
8OB8II8DDD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ABT-418, (R)-
Code English
3-METHYL-5-(1-METHYL-2(R)-PYRROLIDINYL)ISOXAZOLE
Systematic Name English
ISOXAZOLE, 3-METHYL-5-(1-METHYL-2-PYRROLIDINYL)-, (R)-
Systematic Name English
3-METHYL-5-(1-METHYL-2(R)-PYRROLIDINYL)ISOXAZOLE ((R)-ISOMER)
Common Name English
ISOXAZOLE, 3-METHYL-5-((2R)-1-METHYL-2-PYRROLIDINYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
8OB8II8DDD
Created by admin on Sat Dec 16 09:16:28 GMT 2023 , Edited by admin on Sat Dec 16 09:16:28 GMT 2023
PRIMARY
PUBCHEM
9859069
Created by admin on Sat Dec 16 09:16:28 GMT 2023 , Edited by admin on Sat Dec 16 09:16:28 GMT 2023
PRIMARY
CAS
147402-73-1
Created by admin on Sat Dec 16 09:16:28 GMT 2023 , Edited by admin on Sat Dec 16 09:16:28 GMT 2023
PRIMARY