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Details

Stereochemistry ACHIRAL
Molecular Formula C21H16ClN3O3
Molecular Weight 393.823
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(5-CHLOROBENZOXAZOL-2-YL)-7-(DIETHYLAMINO)-2-OXO-2H-1-BENZOPYRAN-4-CARBONITRILE

SMILES

CCN(CC)C1=CC=C2C(OC(=O)C(C3=NC4=CC(Cl)=CC=C4O3)=C2C#N)=C1

InChI

InChIKey=AMMKISDXNUDHFE-UHFFFAOYSA-N
InChI=1S/C21H16ClN3O3/c1-3-25(4-2)13-6-7-14-15(11-23)19(21(26)28-18(14)10-13)20-24-16-9-12(22)5-8-17(16)27-20/h5-10H,3-4H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
3-(5-CHLOROBENZOXAZOL-2-YL)-7-(DIETHYLAMINO)-2-OXO-2H-1-BENZOPYRAN-4-CARBONITRILE
Systematic Name English
2H-1-BENZOPYRAN-4-CARBONITRILE, 3-(5-CHLORO-2-BENZOXAZOLYL)-7-(DIETHYLAMINO)-2-OXO-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
274-667-3
Created by admin on Sat Dec 16 12:32:15 GMT 2023 , Edited by admin on Sat Dec 16 12:32:15 GMT 2023
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EPA CompTox
DTXSID80220825
Created by admin on Sat Dec 16 12:32:15 GMT 2023 , Edited by admin on Sat Dec 16 12:32:15 GMT 2023
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PUBCHEM
16205230
Created by admin on Sat Dec 16 12:32:15 GMT 2023 , Edited by admin on Sat Dec 16 12:32:15 GMT 2023
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CAS
70546-12-2
Created by admin on Sat Dec 16 12:32:15 GMT 2023 , Edited by admin on Sat Dec 16 12:32:15 GMT 2023
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FDA UNII
BTZ4GA32EG
Created by admin on Sat Dec 16 12:32:15 GMT 2023 , Edited by admin on Sat Dec 16 12:32:15 GMT 2023
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