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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H28N4O2
Molecular Weight 404.5047
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of APP-CHMINACA

SMILES

NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=NN(CC3CCCCC3)C4=CC=CC=C24

InChI

InChIKey=DMHWDSGURMXMGE-FQEVSTJZSA-N
InChI=1S/C24H28N4O2/c25-23(29)20(15-17-9-3-1-4-10-17)26-24(30)22-19-13-7-8-14-21(19)28(27-22)16-18-11-5-2-6-12-18/h1,3-4,7-10,13-14,18,20H,2,5-6,11-12,15-16H2,(H2,25,29)(H,26,30)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H28N4O2
Molecular Weight 404.5047
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
3877T06H05
Record Status Validated (UNII)
Record Version