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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H10ClNO2.ClH
Molecular Weight 236.095
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FENCLONINE HYDROCHLORIDE, (S)-

SMILES

Cl.N[C@@H](CC1=CC=C(Cl)C=C1)C(O)=O

InChI

InChIKey=PFOCEDBJFKVRHU-QRPNPIFTSA-N
InChI=1S/C9H10ClNO2.ClH/c10-7-3-1-6(2-4-7)5-8(11)9(12)13;/h1-4,8H,5,11H2,(H,12,13);1H/t8-;/m0./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C9H10ClNO2
Molecular Weight 199.634
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
N2826ONK11
Record Status Validated (UNII)
Record Version