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Details

Stereochemistry ACHIRAL
Molecular Formula C18H15N3O4
Molecular Weight 337.3294
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 3-[[(4-nitrophenyl)methylene]amino]-1H-indole-2-carboxylate

SMILES

CCOC(=O)C1=C(\N=C\C2=CC=C(C=C2)[N+]([O-])=O)C3=CC=CC=C3N1

InChI

InChIKey=QDPMSHBLIUFLDS-YBFXNURJSA-N
InChI=1S/C18H15N3O4/c1-2-25-18(22)17-16(14-5-3-4-6-15(14)20-17)19-11-12-7-9-13(10-8-12)21(23)24/h3-11,20H,2H2,1H3/b19-11+

HIDE SMILES / InChI

Molecular Formula C18H15N3O4
Molecular Weight 337.3294
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:13:29 GMT 2023
Edited
by admin
on Sat Dec 16 08:13:29 GMT 2023
Record UNII
PAJ4MER8RC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethyl 3-[[(4-nitrophenyl)methylene]amino]-1H-indole-2-carboxylate
Systematic Name English
1H-Indole-2-carboxylic acid, 3-[[(4-nitrophenyl)methylene]amino]-, ethyl ester
Systematic Name English
3-(((4-Nitrophenyl)methylene)amino)-1H-indole-2-carboxylic acid, ethyl ester
Common Name English
Code System Code Type Description
CAS
143603-72-9
Created by admin on Sat Dec 16 08:13:29 GMT 2023 , Edited by admin on Sat Dec 16 08:13:29 GMT 2023
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FDA UNII
PAJ4MER8RC
Created by admin on Sat Dec 16 08:13:29 GMT 2023 , Edited by admin on Sat Dec 16 08:13:29 GMT 2023
PRIMARY
PUBCHEM
154565
Created by admin on Sat Dec 16 08:13:29 GMT 2023 , Edited by admin on Sat Dec 16 08:13:29 GMT 2023
PRIMARY
EPA CompTox
DTXSID001030436
Created by admin on Sat Dec 16 08:13:29 GMT 2023 , Edited by admin on Sat Dec 16 08:13:29 GMT 2023
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