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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H21ClN2.H3O4P
Molecular Weight 398.821
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLOMACRAN PHOSPHATE, (R)-

SMILES

OP(O)(O)=O.CN(C)CCC[C@@H]1C2=C(NC3=C1C=C(Cl)C=C3)C=CC=C2

InChI

InChIKey=SKKDWRIEPIZVOR-PFEQFJNWSA-N
InChI=1S/C18H21ClN2.H3O4P/c1-21(2)11-5-7-14-15-6-3-4-8-17(15)20-18-10-9-13(19)12-16(14)18;1-5(2,3)4/h3-4,6,8-10,12,14,20H,5,7,11H2,1-2H3;(H3,1,2,3,4)/t14-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C18H21ClN2
Molecular Weight 300.826
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula H3O4P
Molecular Weight 97.9952
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:07:09 GMT 2023
Edited
by admin
on Sat Dec 16 11:07:09 GMT 2023
Record UNII
3D11028978
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CLOMACRAN PHOSPHATE, (R)-
Common Name English
9-ACRIDINEPROPANAMINE, 2-CHLORO-9,10-DIHYDRO-N,N-DIMETHYL-, PHOSPHATE, (R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76956309
Created by admin on Sat Dec 16 11:07:09 GMT 2023 , Edited by admin on Sat Dec 16 11:07:09 GMT 2023
PRIMARY
FDA UNII
3D11028978
Created by admin on Sat Dec 16 11:07:09 GMT 2023 , Edited by admin on Sat Dec 16 11:07:09 GMT 2023
PRIMARY
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