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Details

Stereochemistry ACHIRAL
Molecular Formula C12H13NO2
Molecular Weight 203.2371
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL INDOLE-3-PROPANOATE

SMILES

COC(=O)CCC1=CNC2=C1C=CC=C2

InChI

InChIKey=BAYIDMGOQRXHBC-UHFFFAOYSA-N
InChI=1S/C12H13NO2/c1-15-12(14)7-6-9-8-13-11-5-3-2-4-10(9)11/h2-5,8,13H,6-7H2,1H3

HIDE SMILES / InChI

Molecular Formula C12H13NO2
Molecular Weight 203.2371
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 20:02:28 GMT 2025
Edited
by admin
on Mon Mar 31 20:02:28 GMT 2025
Record UNII
PR3BRO222F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL INDOLE-3-PROPANOATE
Systematic Name English
NSC-56004
Preferred Name English
1H-INDOLE-3-PROPANOIC ACID, METHYL ESTER
Systematic Name English
INDOLE-3-PROPIONIC ACID, METHYL ESTER
Common Name English
Code System Code Type Description
FDA UNII
PR3BRO222F
Created by admin on Mon Mar 31 20:02:29 GMT 2025 , Edited by admin on Mon Mar 31 20:02:29 GMT 2025
PRIMARY
EPA CompTox
DTXSID50204056
Created by admin on Mon Mar 31 20:02:29 GMT 2025 , Edited by admin on Mon Mar 31 20:02:29 GMT 2025
PRIMARY
CAS
5548-09-4
Created by admin on Mon Mar 31 20:02:29 GMT 2025 , Edited by admin on Mon Mar 31 20:02:29 GMT 2025
PRIMARY
PUBCHEM
21711
Created by admin on Mon Mar 31 20:02:29 GMT 2025 , Edited by admin on Mon Mar 31 20:02:29 GMT 2025
PRIMARY
NSC
56004
Created by admin on Mon Mar 31 20:02:29 GMT 2025 , Edited by admin on Mon Mar 31 20:02:29 GMT 2025
PRIMARY