MIN-117

Investigational

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H25Cl2N3O4.ClH
Molecular Weight	538.851
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CC1=NN=C(O1)C2=CC3=C(OC[C@@H](O)CN4CCC(CC4)C5=CC(Cl)=C(Cl)C=C5)C=CC=C3O2

InChI

InChIKey=HRNDUKHBCUTNAL-FERBBOLQSA-N

InChI=1S/C25H25Cl2N3O4.ClH/c1-15-28-29-25(33-15)24-12-19-22(3-2-4-23(19)34-24)32-14-18(31)13-30-9-7-16(8-10-30)17-5-6-20(26)21(27)11-17;/h2-6,11-12,16,18,31H,7-10,13-14H2,1H3;1H/t18-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C25H25Cl2N3O4
Molecular Weight	502.39
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 12:12:51 UTC 2023` Edited by `admin` on `Sat Dec 16 12:12:51 UTC 2023`
Record UNII	APU2W4Y452
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MIN-117

Code

English

WF-516

Code

English

WF516

Code

English

1-PIPERIDINEETHANOL, 4-(3,4-DICHLOROPHENYL)-.ALPHA.-(((2-(5-METHYL-1,3,4-OXADIAZOL-2-YL)-4-BENZOFURANYL)OXY)METHYL)-, HYDROCHLORIDE (1:1), (.ALPHA.S)-

Systematic Name

English

(2S)-1-(4-(3,4-DICHLOROPHENYL)-1-PIPERIDYL)-3-(2-(5-METHYL-1,3,4-OXADIAZOL-2-YL)BENZOFURAN-4-YL)OXY-PROPAN-2-OL HYDROCHLORIDE

Systematic Name

English

1-PIPERIDINEETHANOL, 4-(3,4-DICHLOROPHENYL)-.ALPHA.-(((2-(5-METHYL-1,3,4-OXADIAZOL-2-YL)-4-BENZOFURANYL)OXY)METHYL)-, MONOHYDROCHLORIDE, (.ALPHA.S)-

Systematic Name

English

Code System Code Type Description

MANUFACTURER PRODUCT INFORMATION

WF-516