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Details

Stereochemistry RACEMIC
Molecular Formula C17H26N2O2.ClH
Molecular Weight 326.861
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of D-617 HYDROCHLORIDE

SMILES

Cl.CNCCCC(C#N)(C(C)C)C1=CC(OC)=C(OC)C=C1

InChI

InChIKey=ARLOHZJIIHSRFE-UHFFFAOYSA-N
InChI=1S/C17H26N2O2.ClH/c1-13(2)17(12-18,9-6-10-19-3)14-7-8-15(20-4)16(11-14)21-5;/h7-8,11,13,19H,6,9-10H2,1-5H3;1H

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 C17H26N2O2
Molecular Weight 290.4005
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
J368YCA39W
Record Status Validated (UNII)
Record Version