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Details

Stereochemistry MIXED
Molecular Formula C15H17ClN4O
Molecular Weight 304.775
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MYCLOBUTANIL HYDROXIDE

SMILES

CC(O)CCC(CN1C=NC=N1)(C#N)C2=CC=C(Cl)C=C2

InChI

InChIKey=HIUOATAFAFIXAL-UHFFFAOYSA-N
InChI=1S/C15H17ClN4O/c1-12(21)6-7-15(8-17,9-20-11-18-10-19-20)13-2-4-14(16)5-3-13/h2-5,10-12,21H,6-7,9H2,1H3

HIDE SMILES / InChI

Molecular Formula C15H17ClN4O
Molecular Weight 304.775
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
6WPK17I4HM
Record Status Validated (UNII)
Record Version