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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H17Cl2NO.ClH
Molecular Weight 358.69
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICLOFENSINE HYDROCHLORIDE, (S)-

SMILES

Cl.COC1=CC2=C(C=C1)[C@@H](CN(C)C2)C3=CC(Cl)=C(Cl)C=C3

InChI

InChIKey=PEHOXCSPLOXNOK-RSAXXLAASA-N
InChI=1S/C17H17Cl2NO.ClH/c1-20-9-12-7-13(21-2)4-5-14(12)15(10-20)11-3-6-16(18)17(19)8-11;/h3-8,15H,9-10H2,1-2H3;1H/t15-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C17H17Cl2NO
Molecular Weight 322.229
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:28:38 GMT 2023
Edited
by admin
on Sat Dec 16 10:28:38 GMT 2023
Record UNII
16V730563Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DICLOFENSINE HYDROCHLORIDE, (S)-
Common Name English
ISOQUINOLINE, 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-7-METHOXY-2-METHYL-, HYDROCHLORIDE, (S)-
Systematic Name English
Code System Code Type Description
CAS
43073-01-4
Created by admin on Sat Dec 16 10:28:38 GMT 2023 , Edited by admin on Sat Dec 16 10:28:38 GMT 2023
PRIMARY
PUBCHEM
76963229
Created by admin on Sat Dec 16 10:28:38 GMT 2023 , Edited by admin on Sat Dec 16 10:28:38 GMT 2023
PRIMARY
FDA UNII
16V730563Q
Created by admin on Sat Dec 16 10:28:38 GMT 2023 , Edited by admin on Sat Dec 16 10:28:38 GMT 2023
PRIMARY
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