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Details

Stereochemistry ACHIRAL
Molecular Formula C36H34N6O4
Molecular Weight 614.693
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 2

SHOW SMILES / InChI
Structure of SN-5754 CATION

SMILES

CC[N+]1=CC(NC(=O)C2=CC=C(NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC=C[N+](CC)=C5)C=C2)=CC=C1

InChI

InChIKey=GZSNFNKIKQAWLD-UHFFFAOYSA-P
InChI=1S/C36H32N6O4/c1-3-41-21-5-7-31(23-41)39-35(45)27-13-17-29(18-14-27)37-33(43)25-9-11-26(12-10-25)34(44)38-30-19-15-28(16-20-30)36(46)40-32-8-6-22-42(4-2)24-32/h5-24H,3-4H2,1-2H3,(H2-2,37,38,39,40,43,44,45,46)/p+2

HIDE SMILES / InChI

Molecular Formula C36H34N6O4
Molecular Weight 614.693
Charge 2
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
KO07C5CBUD
Record Status Validated (UNII)
Record Version