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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H24Cl2F2O2
Molecular Weight 417.317
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PREGNA-1,4-DIENE-3,20-DIONE, 9,11.BETA.-DICHLORO-6.ALPHA.,21-DIFLUORO-

SMILES

[H][C@@]12CC[C@H](C(=O)CF)[C@@]1(C)C[C@H](Cl)[C@@]3(Cl)[C@@]2([H])C[C@H](F)C4=CC(=O)C=C[C@]34C

InChI

InChIKey=NWMSYITVQXEGJD-PAPZHHRGSA-N
InChI=1S/C21H24Cl2F2O2/c1-19-9-18(22)21(23)14(12(19)3-4-13(19)17(27)10-24)8-16(25)15-7-11(26)5-6-20(15,21)2/h5-7,12-14,16,18H,3-4,8-10H2,1-2H3/t12-,13+,14-,16-,18-,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H24Cl2F2O2
Molecular Weight 417.317
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
1P08TXF27C
Record Status Validated (UNII)
Record Version