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Details

Stereochemistry ABSOLUTE
Molecular Formula C7H11N3O3
Molecular Weight 185.1805
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SECNIDAZOLE, (R)-

SMILES

C[C@@H](O)CN1C(C)=NC=C1[N+]([O-])=O

InChI

InChIKey=KPQZUUQMTUIKBP-RXMQYKEDSA-N
InChI=1S/C7H11N3O3/c1-5(11)4-9-6(2)8-3-7(9)10(12)13/h3,5,11H,4H2,1-2H3/t5-/m1/s1

HIDE SMILES / InChI

Molecular Formula C7H11N3O3
Molecular Weight 185.1805
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:10:16 UTC 2023
Edited
by admin
on Sat Dec 16 18:10:16 UTC 2023
Record UNII
7551F316CJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SECNIDAZOLE, (R)-
Common Name English
SECNIDAZOLE, (-)-
Common Name English
1H-IMIDAZOLE-1-ETHANOL, .ALPHA.,2-DIMETHYL-5-NITRO-, (.ALPHA.R)
Systematic Name English
(.ALPHA.R)-.ALPHA.,2-DIMETHYL-5-NITRO-1H-IMIDAZOLE-1-ETHANOL
Common Name English
Code System Code Type Description
PUBCHEM
667451
Created by admin on Sat Dec 16 18:10:16 UTC 2023 , Edited by admin on Sat Dec 16 18:10:16 UTC 2023
PRIMARY
CAS
618911-61-8
Created by admin on Sat Dec 16 18:10:16 UTC 2023 , Edited by admin on Sat Dec 16 18:10:16 UTC 2023
PRIMARY
FDA UNII
7551F316CJ
Created by admin on Sat Dec 16 18:10:16 UTC 2023 , Edited by admin on Sat Dec 16 18:10:16 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER