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Details

Stereochemistry MIXED
Molecular Formula C22H35NO3
Molecular Weight 361.5182
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-DESPHENYL-.ALPHA.-CYCLOHEXENYL OXYBUTYNIN

SMILES

CCN(CC)CC#CCOC(=O)C(O)(C1CCCCC1)C2CCC=CC2

InChI

InChIKey=JLKIQERNEYLJLA-UHFFFAOYSA-N
InChI=1S/C22H35NO3/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5,7,19-20,25H,3-4,6,8-10,13-18H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C22H35NO3
Molecular Weight 361.5182
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
J6ALC99FKD
Record Status Validated (UNII)
Record Version