RTI-126 HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H21N3O.ClH
Molecular Weight	319.829
Optical Activity	( + )
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)C3=CC=CC=C3)C4=NC(C)=NO4

InChI

InChIKey=XXIIMJGLCRGJJL-GBQFRTIMSA-N

InChI=1S/C17H21N3O.ClH/c1-11-18-17(21-19-11)16-14(12-6-4-3-5-7-12)10-13-8-9-15(16)20(13)2;/h3-7,13-16H,8-10H2,1-2H3;1H/t13-,14+,15+,16-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C17H21N3O
Molecular Weight	283.3681
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
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 18:47:06 UTC 2023` Edited by `admin` on `Sat Dec 16 18:47:06 UTC 2023`
Record UNII	97YJR5A3TZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RTI-126 HYDROCHLORIDE

Code

English

8-AZABICYCLO(3.2.1)OCTANE, 8-METHYL-2-(3-METHYL-1,2,4-OXADIAZOL-5-YL)-3-PHENYL-, HYDROCHLORIDE (1:1), (1R,2S,3S,5S)-

Systematic Name

English

8-AZABICYCLO(3.2.1)OCTANE, 8-METHYL-2-(3-METHYL-1,2,4-OXADIAZOL-5-YL)-3-PHENYL-, MONOHYDROCHLORIDE, (1R,2S,3S,5S)-

Systematic Name

English

8-AZABICYCLO(3.2.1)OCTANE, 8-METHYL-2-(3-METHYL-1,2,4-OXADIAZOL-5-YL)-3-PHENYL-, MONOHYDROCHLORIDE, (1R-(EXO,EXO))-

Systematic Name

English

Code System Code Type Description

FDA UNII

97YJR5A3TZ

Created by admin on Sat Dec 16 18:47:06 UTC 2023 , Edited by admin on Sat Dec 16 18:47:06 UTC 2023

PRIMARY

EPA CompTox

DTXSID00858306

Created by admin on Sat Dec 16 18:47:06 UTC 2023 , Edited by admin on Sat Dec 16 18:47:06 UTC 2023

PRIMARY

PUBCHEM

131873944

Created by admin on Sat Dec 16 18:47:06 UTC 2023 , Edited by admin on Sat Dec 16 18:47:06 UTC 2023

PRIMARY

PUBCHEM

CAS

147059-95-8

Created by admin on Sat Dec 16 18:47:06 UTC 2023 , Edited by admin on Sat Dec 16 18:47:06 UTC 2023

PRIMARY

Related Record Type Details


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RTI-126

PARENT -> SALT/SOLVATE

Amount: