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Details

Stereochemistry ACHIRAL
Molecular Formula C21H34N2O5.ClH
Molecular Weight 430.966
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OPIRANSERIN HYDROCHLORIDE

SMILES

Cl.CCCCOC1=C(OC)C=C(C=C1OC)C(=O)NCC2(CCOCC2)N(C)C

InChI

InChIKey=GSCGQHXDHYVKOL-UHFFFAOYSA-N
InChI=1S/C21H34N2O5.ClH/c1-6-7-10-28-19-17(25-4)13-16(14-18(19)26-5)20(24)22-15-21(23(2)3)8-11-27-12-9-21;/h13-14H,6-12,15H2,1-5H3,(H,22,24);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 C21H34N2O5
Molecular Weight 394.5051
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

Approval Year

Substance Class Chemical
Record UNII
TV5HX81OTX
Record Status Validated (UNII)
Record Version