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Details

Stereochemistry ACHIRAL
Molecular Formula C15H24N2O2.2ClH
Molecular Weight 337.285
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(dimethylamino)-2-[(dimethylamino)methyl]-1-(4-methoxyphenyl)propan-1-one dihydrochloride

SMILES

Cl.Cl.COC1=CC=C(C=C1)C(=O)C(CN(C)C)CN(C)C

InChI

InChIKey=BIXNKSPEZUDRMD-UHFFFAOYSA-N
InChI=1S/C15H24N2O2.2ClH/c1-16(2)10-13(11-17(3)4)15(18)12-6-8-14(19-5)9-7-12;;/h6-9,13H,10-11H2,1-5H3;2*1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C15H24N2O2
Molecular Weight 264.3633
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 12:50:19 GMT 2023
Edited
by admin
on Sat Dec 16 12:50:19 GMT 2023
Record UNII
VMS9TA56B7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(dimethylamino)-2-[(dimethylamino)methyl]-1-(4-methoxyphenyl)propan-1-one dihydrochloride
Systematic Name English
1-Propanone, 3-(dimethylamino)-2-[(dimethylamino)methyl]-1-(4-methoxyphenyl)-, hydrochloride (1:2)
Systematic Name English
NSC-317917
Code English
1-Propanone, 3-(dimethylamino)-2-[(dimethylamino)methyl]-1-(4-methoxyphenyl)-, dihydrochloride
Systematic Name English
Code System Code Type Description
PUBCHEM
128925
Created by admin on Sat Dec 16 12:50:19 GMT 2023 , Edited by admin on Sat Dec 16 12:50:19 GMT 2023
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FDA UNII
VMS9TA56B7
Created by admin on Sat Dec 16 12:50:19 GMT 2023 , Edited by admin on Sat Dec 16 12:50:19 GMT 2023
PRIMARY
CAS
90548-62-2
Created by admin on Sat Dec 16 12:50:19 GMT 2023 , Edited by admin on Sat Dec 16 12:50:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID60920331
Created by admin on Sat Dec 16 12:50:19 GMT 2023 , Edited by admin on Sat Dec 16 12:50:19 GMT 2023
PRIMARY
NSC
317917
Created by admin on Sat Dec 16 12:50:19 GMT 2023 , Edited by admin on Sat Dec 16 12:50:19 GMT 2023
PRIMARY