Homoepibatidine, (±)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H15ClN2
Molecular Weight	222.714
Optical Activity	( + / - )
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@H](C3=CN=C(Cl)C=C3)[C@]([H])(CCC1)N2

InChI

InChIKey=GDSORCYTZJIZHU-VWYCJHECSA-N

InChI=1S/C12H15ClN2/c13-12-5-4-8(7-14-12)10-6-9-2-1-3-11(10)15-9/h4-5,7,9-11,15H,1-3,6H2/t9-,10+,11+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C12H15ClN2
Molecular Weight	222.714
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:38:38 GMT 2023` Edited by `admin` on `Sat Dec 16 16:38:38 GMT 2023`
Record UNII	49BJP52HFZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Homoepibatidine, (±)-

Common Name

English

8-Azabicyclo[3.2.1]octane, 6-(6-chloro-3-pyridinyl)-, exo-

Systematic Name

English

rel-(1R,5S,6S)-6-(6-Chloro-3-pyridinyl)-8-azabicyclo[3.2.1]octane

Systematic Name

English

(±)-Homoepibatidine

Common Name

English

8-Azabicyclo[3.2.1]octane, 6-(6-chloro-3-pyridinyl)-, (1R,5S,6S)-rel-

Systematic Name

English

(1R,5S,6S)-6-(6-chloropyridin-3-yl)-8-azabicyclo[3.2.1]octane

Systematic Name

English

Nonsymmetric homoepibatidine

Common Name

English

Homoepibatidine

Common Name

English

Code System Code Type Description

FDA UNII

49BJP52HFZ

Created by admin on Sat Dec 16 16:38:38 GMT 2023 , Edited by admin on Sat Dec 16 16:38:38 GMT 2023

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PUBCHEM

154032

Created by admin on Sat Dec 16 16:38:38 GMT 2023 , Edited by admin on Sat Dec 16 16:38:38 GMT 2023

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CAS

174789-85-6

Created by admin on Sat Dec 16 16:38:38 GMT 2023 , Edited by admin on Sat Dec 16 16:38:38 GMT 2023

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EPA CompTox

DTXSID90938580

Created by admin on Sat Dec 16 16:38:38 GMT 2023 , Edited by admin on Sat Dec 16 16:38:38 GMT 2023

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