U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry RACEMIC
Molecular Formula C25H27ClN2
Molecular Weight 390.948
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MECLIZINE O-CHLORO ISOMER

SMILES

CC1=CC(CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4Cl)=CC=C1

InChI

InChIKey=FYSDBFPGERHMNE-UHFFFAOYSA-N
InChI=1S/C25H27ClN2/c1-20-8-7-9-21(18-20)19-27-14-16-28(17-15-27)25(22-10-3-2-4-11-22)23-12-5-6-13-24(23)26/h2-13,18,25H,14-17,19H2,1H3

HIDE SMILES / InChI

Molecular Formula C25H27ClN2
Molecular Weight 390.948
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
W2O858539O
Record Status Validated (UNII)
Record Version