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

Details

Stereochemistry ACHIRAL
Molecular Formula C18H17NO3
Molecular Weight 295.3325
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(Benzyloxy)-2-carbethoxyindole

SMILES

CCOC(=O)C1=CC2=CC(OCC3=CC=CC=C3)=CC=C2N1

InChI

InChIKey=DCIFXYFKVKDOLL-UHFFFAOYSA-N
InChI=1S/C18H17NO3/c1-2-21-18(20)17-11-14-10-15(8-9-16(14)19-17)22-12-13-6-4-3-5-7-13/h3-11,19H,2,12H2,1H3

HIDE SMILES / InChI

Molecular Formula C18H17NO3
Molecular Weight 295.3325
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 12:35:27 GMT 2023
Edited
by admin
on Sat Dec 16 12:35:27 GMT 2023
Record UNII
U8E35U2DWT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-(Benzyloxy)-2-carbethoxyindole
Systematic Name English
1H-Indole-2-carboxylic acid, 5-(phenylmethoxy)-, ethyl ester
Systematic Name English
Ethyl 5-(phenylmethoxy)-1H-indole-2-carboxylate
Systematic Name English
NSC-30931
Code English
2-Carbethoxy-5-(benzyloxy)indole
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
253-322-0
Created by admin on Sat Dec 16 12:35:27 GMT 2023 , Edited by admin on Sat Dec 16 12:35:27 GMT 2023
PRIMARY
FDA UNII
U8E35U2DWT
Created by admin on Sat Dec 16 12:35:27 GMT 2023 , Edited by admin on Sat Dec 16 12:35:27 GMT 2023
PRIMARY
PUBCHEM
95721
Created by admin on Sat Dec 16 12:35:27 GMT 2023 , Edited by admin on Sat Dec 16 12:35:27 GMT 2023
PRIMARY
CAS
37033-95-7
Created by admin on Sat Dec 16 12:35:27 GMT 2023 , Edited by admin on Sat Dec 16 12:35:27 GMT 2023
PRIMARY
NSC
30931
Created by admin on Sat Dec 16 12:35:27 GMT 2023 , Edited by admin on Sat Dec 16 12:35:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID20190538
Created by admin on Sat Dec 16 12:35:27 GMT 2023 , Edited by admin on Sat Dec 16 12:35:27 GMT 2023
PRIMARY