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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H14Cl4N2O.HNO3
Molecular Weight 479.141
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOCONAZOLE NITRATE, (R)-

SMILES

O[N+]([O-])=O.ClC1=CC(Cl)=C(C=C1)[C@H](CN2C=CN=C2)OCC3=C(Cl)C=CC=C3Cl

InChI

InChIKey=NNGQLSIGRSTLLU-FERBBOLQSA-N
InChI=1S/C18H14Cl4N2O.HNO3/c19-12-4-5-13(17(22)8-12)18(9-24-7-6-23-11-24)25-10-14-15(20)2-1-3-16(14)21;2-1(3)4/h1-8,11,18H,9-10H2;(H,2,3,4)/t18-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C18H14Cl4N2O
Molecular Weight 416.129
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula HNO3
Molecular Weight 63.0128
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 11:48:07 GMT 2023
Edited
by admin
on Sat Dec 16 11:48:07 GMT 2023
Record UNII
Z375MCM79E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOCONAZOLE NITRATE, (R)-
Common Name English
1H-IMIDAZOLE, 1-(2-(2,4-DICHLOROPHENYL)-2-((2,6-DICHLOROPHENYL)METHOXY)ETHYL)-, NITRATE (1:1), (R)-
Systematic Name English
Code System Code Type Description
FDA UNII
Z375MCM79E
Created by admin on Sat Dec 16 11:48:08 GMT 2023 , Edited by admin on Sat Dec 16 11:48:08 GMT 2023
PRIMARY
PUBCHEM
76965528
Created by admin on Sat Dec 16 11:48:08 GMT 2023 , Edited by admin on Sat Dec 16 11:48:08 GMT 2023
PRIMARY
Related Record Type Details
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