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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H31N3O3
Molecular Weight 385.4998
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MDMB-CHMINACA

SMILES

COC(=O)[C@@H](NC(=O)C1=NN(CC2CCCCC2)C3=C1C=CC=C3)C(C)(C)C

InChI

InChIKey=DGQMLBSSRFFINY-LJQANCHMSA-N
InChI=1S/C22H31N3O3/c1-22(2,3)19(21(27)28-4)23-20(26)18-16-12-8-9-13-17(16)25(24-18)14-15-10-6-5-7-11-15/h8-9,12-13,15,19H,5-7,10-11,14H2,1-4H3,(H,23,26)/t19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H31N3O3
Molecular Weight 385.4998
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
Z6EXBVG316
Record Status Validated (UNII)
Record Version