U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C11H9NO2
Molecular Weight 187.1947
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-ACETYL-1H-INDOLE-3-CARBALDEHYDE

SMILES

CC(=O)N1C=C(C=O)C2=C1C=CC=C2

InChI

InChIKey=LCJLFGSKHBDOAY-UHFFFAOYSA-N
InChI=1S/C11H9NO2/c1-8(14)12-6-9(7-13)10-4-2-3-5-11(10)12/h2-7H,1H3

HIDE SMILES / InChI

Molecular Formula C11H9NO2
Molecular Weight 187.1947
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 Sat Dec 16 12:28:06 GMT 2023
Edited
by admin
on Sat Dec 16 12:28:06 GMT 2023
Record UNII
56ESZ895CE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-ACETYL-1H-INDOLE-3-CARBALDEHYDE
Systematic Name English
NSC-61289
Code English
1H-INDOLE-3-CARBOXALDEHYDE, 1-ACETYL-
Systematic Name English
INDOLE-3-CARBOXALDEHYDE, 1-ACETYL-
Systematic Name English
N-ACETYL-3-INDOLECARBOXALDEHYDE
Systematic Name English
1-ACETYL-3-INDOLECARBOXALDEHYDE
Common Name English
Code System Code Type Description
FDA UNII
56ESZ895CE
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
245-347-0
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
CAS
22948-94-3
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID60177489
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
NSC
61289
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
PUBCHEM
89915
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
CHEBI
133207
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY