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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H17N3O2
Molecular Weight 259.3037
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4S)-4-((3-(2-AMINOETHYL)-1H-INDOL-5-YL)METHYL)-1,3-OXAZOLIDIN-2-ONE

SMILES

NCCC1=CNC2=C1C=C(C[C@H]3COC(=O)N3)C=C2

InChI

InChIKey=NKOBWHOGNBPTDO-NSHDSACASA-N
InChI=1S/C14H17N3O2/c15-4-3-10-7-16-13-2-1-9(6-12(10)13)5-11-8-19-14(18)17-11/h1-2,6-7,11,16H,3-5,8,15H2,(H,17,18)/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H17N3O2
Molecular Weight 259.3037
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 15:06:47 GMT 2023
Edited
by admin
on Sat Dec 16 15:06:47 GMT 2023
Record UNII
3FM32M4RD3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4S)-4-((3-(2-AMINOETHYL)-1H-INDOL-5-YL)METHYL)-1,3-OXAZOLIDIN-2-ONE
Systematic Name English
2-OXAZOLIDINONE, 4-((3-(2-AMINOETHYL)-1H-INDOL-5-YL)METHYL)-, (4S)-
Systematic Name English
(S)-4-((3-(2-AMINOETHYL)-1H-INDOL-5-YL)METHYL)OXAZOLIDIN-2-ONE
Systematic Name English
ZOLMITRIPTAN IMPURITY D [EP IMPURITY]
Common Name English
2-OXAZOLIDINONE, 4-((3-(2-AMINOETHYL)-1H-INDOL-5-YL)METHYL)-, (S)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID60661919
Created by admin on Sat Dec 16 15:06:47 GMT 2023 , Edited by admin on Sat Dec 16 15:06:47 GMT 2023
PRIMARY
PUBCHEM
10061112
Created by admin on Sat Dec 16 15:06:47 GMT 2023 , Edited by admin on Sat Dec 16 15:06:47 GMT 2023
PRIMARY
CAS
139264-15-6
Created by admin on Sat Dec 16 15:06:47 GMT 2023 , Edited by admin on Sat Dec 16 15:06:47 GMT 2023
PRIMARY
FDA UNII
3FM32M4RD3
Created by admin on Sat Dec 16 15:06:47 GMT 2023 , Edited by admin on Sat Dec 16 15:06:47 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP