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Details

Stereochemistry RACEMIC
Molecular Formula C19H14NO6.Na
Molecular Weight 375.3073
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACENOCOUMAROL SODIUM

SMILES

[Na+].CC(=O)CC(C1=CC=C(C=C1)[N+]([O-])=O)C2=C([O-])C3=CC=CC=C3OC2=O

InChI

InChIKey=MPRDFQJZNXOBJT-UHFFFAOYSA-M
InChI=1S/C19H15NO6.Na/c1-11(21)10-15(12-6-8-13(9-7-12)20(24)25)17-18(22)14-4-2-3-5-16(14)26-19(17)23;/h2-9,15,22H,10H2,1H3;/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
ACENOCOUMAROL SODIUM
Common Name English
2H-1-BENZOPYRAN-2-ONE, 4-HYDROXY-3-(1-(4-NITROPHENYL)-3-OXOBUTYL)-, SODIUM SALT (1:1)
Systematic Name English
2H-1-BENZOPYRAN-2-ONE, 4-HYDROXY-3-(1-(4-NITROPHENYL)-3-OXOBUTYL)-, SODIUM SALT
Systematic Name English
Code System Code Type Description
FDA UNII
RI0I5706FO
Created by admin on Sat Dec 16 09:08:16 UTC 2023 , Edited by admin on Sat Dec 16 09:08:16 UTC 2023
PRIMARY
CAS
278187-65-8
Created by admin on Sat Dec 16 09:08:16 UTC 2023 , Edited by admin on Sat Dec 16 09:08:16 UTC 2023
ALTERNATIVE
CAS
72756-65-1
Created by admin on Sat Dec 16 09:08:16 UTC 2023 , Edited by admin on Sat Dec 16 09:08:16 UTC 2023
PRIMARY
PUBCHEM
15407324
Created by admin on Sat Dec 16 09:08:16 UTC 2023 , Edited by admin on Sat Dec 16 09:08:16 UTC 2023
PRIMARY