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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H19ClN2O.C4H4O4
Molecular Weight 406.86
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CARBINOXAMINE MALEATE, (R)-

SMILES

OC(=O)\C=C/C(O)=O.CN(C)CCO[C@H](C1=CC=C(Cl)C=C1)C2=CC=CC=N2

InChI

InChIKey=GVNWHCVWDRNXAZ-MLCLTIQSSA-N
InChI=1S/C16H19ClN2O.C4H4O4/c1-19(2)11-12-20-16(15-5-3-4-10-18-15)13-6-8-14(17)9-7-13;5-3(6)1-2-4(7)8/h3-10,16H,11-12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t16-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C4H4O4
Molecular Weight 116.0722
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula C16H19ClN2O
Molecular Weight 290.788
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 08:12:18 UTC 2023
Edited
by admin
on Thu Jul 06 08:12:18 UTC 2023
Record UNII
9FFL1JRS90
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARBINOXAMINE MALEATE, (R)-
Common Name English
ETHANAMINE, 2-((R)-(4-CHLOROPHENYL)-2-PYRIDINYLMETHOXY)-N,N-DIMETHYL-, (2Z)-2-BUTENEDIOATE (1:1)
Systematic Name English
Code System Code Type Description
CAS
1078131-58-4
Created by admin on Thu Jul 06 08:12:18 UTC 2023 , Edited by admin on Thu Jul 06 08:12:18 UTC 2023
PRIMARY
FDA UNII
9FFL1JRS90
Created by admin on Thu Jul 06 08:12:18 UTC 2023 , Edited by admin on Thu Jul 06 08:12:18 UTC 2023
PRIMARY
PUBCHEM
24884235
Created by admin on Thu Jul 06 08:12:18 UTC 2023 , Edited by admin on Thu Jul 06 08:12:18 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER