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Details

Stereochemistry ACHIRAL
Molecular Formula C18H18F3N3O.C4H4O4
Molecular Weight 465.4224
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 10-(2-DIMETHYLAMINOETHYL)-7-(TRIFLUOROMETHYL)-(5H)-DIBENZO(B,E)(1,4)DIAZEPIN-11(10H)ONE MALEATE

SMILES

OC(=O)\C=C/C(O)=O.CN(C)CCN1C2=CC=C(C=C2NC3=C(C=CC=C3)C1=O)C(F)(F)F

InChI

InChIKey=KNELLNRQCZEXBT-BTJKTKAUSA-N
InChI=1S/C18H18F3N3O.C4H4O4/c1-23(2)9-10-24-16-8-7-12(18(19,20)21)11-15(16)22-14-6-4-3-5-13(14)17(24)25;5-3(6)1-2-4(7)8/h3-8,11,22H,9-10H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

HIDE SMILES / InChI

Approval Year

Name Type Language
11H-DIBENZO(B,E)(1,4)DIAZEPIN-11-ONE, 10-(2-(DIMETHYLAMINO)ETHYL)-5,10-DIHYDRO-7-(TRIFLUOROMETHYL)-, 2-BUTENEDIOATE (1:1)
Preferred Name English
10-(2-DIMETHYLAMINOETHYL)-7-(TRIFLUOROMETHYL)-(5H)-DIBENZO(B,E)(1,4)DIAZEPIN-11(10H)ONE MALEATE
Systematic Name English
Code System Code Type Description
FDA UNII
NPI6LZ96ML
Created by admin on Mon Mar 31 17:53:43 GMT 2025 , Edited by admin on Mon Mar 31 17:53:43 GMT 2025
PRIMARY
PUBCHEM
155929080
Created by admin on Mon Mar 31 17:53:43 GMT 2025 , Edited by admin on Mon Mar 31 17:53:43 GMT 2025
PRIMARY
CAS
1785663-15-1
Created by admin on Mon Mar 31 17:53:43 GMT 2025 , Edited by admin on Mon Mar 31 17:53:43 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY