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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H20N2O.ClH
Molecular Weight 328.836
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

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

SMILES

Cl.O[C@H](CN1C=CN=C1)C2=CC=C(CCC3=CC=CC=C3)C=C2

InChI

InChIKey=RBDNRYIXZOBPMV-FSRHSHDFSA-N
InChI=1S/C19H20N2O.ClH/c22-19(14-21-13-12-20-15-21)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16;/h1-5,8-13,15,19,22H,6-7,14H2;1H/t19-;/m1./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 C19H20N2O
Molecular Weight 292.3749
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
42BDT1104T
Record Status Validated (UNII)
Record Version