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Details

Stereochemistry ACHIRAL
Molecular Formula C26H22N2O3
Molecular Weight 410.4645
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of KW-3635 FREE ACID

SMILES

CC1=CC2=C(C=C1C)N(C\C=C3/C4=CC=CC=C4COC5=CC=C(C=C35)C(O)=O)C=N2

InChI

InChIKey=WZXFXUCKNJCHJG-ZVBGSRNCSA-N
InChI=1S/C26H22N2O3/c1-16-11-23-24(12-17(16)2)28(15-27-23)10-9-21-20-6-4-3-5-19(20)14-31-25-8-7-18(26(29)30)13-22(21)25/h3-9,11-13,15H,10,14H2,1-2H3,(H,29,30)/b21-9+

HIDE SMILES / InChI

Molecular Formula C26H22N2O3
Molecular Weight 410.4645
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
U309X7F07W
Record Status Validated (UNII)
Record Version