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Details

Stereochemistry EPIMERIC
Molecular Formula C22H24ClN3O2
Molecular Weight 397.898
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AzelastineN-Oxide, (R)-

SMILES

C[N+]1([O-])CCC[C@H](CC1)N2N=C(CC3=CC=C(Cl)C=C3)C4=CC=CC=C4C2=O

InChI

InChIKey=QFWLGALGCDUDAP-QOBPCVTDSA-N
InChI=1S/C22H24ClN3O2/c1-26(28)13-4-5-18(12-14-26)25-22(27)20-7-3-2-6-19(20)21(24-25)15-16-8-10-17(23)11-9-16/h2-3,6-11,18H,4-5,12-15H2,1H3/t18-,26?/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H24ClN3O2
Molecular Weight 397.898
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:47:49 GMT 2023
Edited
by admin
on Sat Dec 16 19:47:49 GMT 2023
Record UNII
JF5WLD2UUN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AzelastineN-Oxide, (R)-
Common Name English
Azelastine N-Oxide (R)-Isomer
Common Name English
1(2H)-Phthalazinone, 4-[(4-chlorophenyl)methyl]-2-[(4R)-hexahydro-1-methyl-1-oxido-1H-azepin-4-yl]-
Systematic Name English
(R)-AzelastineN-Oxide
Common Name English
4-[(4-Chlorophenyl)methyl]-2-[(4R)-hexahydro-1-methyl-1-oxido-1H-azepin-4-yl]-1(2H)-phthalazinone
Systematic Name English
Code System Code Type Description
FDA UNII
JF5WLD2UUN
Created by admin on Sat Dec 16 19:47:49 GMT 2023 , Edited by admin on Sat Dec 16 19:47:49 GMT 2023
PRIMARY
CAS
1346617-18-2
Created by admin on Sat Dec 16 19:47:49 GMT 2023 , Edited by admin on Sat Dec 16 19:47:49 GMT 2023
PRIMARY
PUBCHEM
71313563
Created by admin on Sat Dec 16 19:47:49 GMT 2023 , Edited by admin on Sat Dec 16 19:47:49 GMT 2023
PRIMARY