(Q27269772)

Arbaclofen hydrochloride (English)

(S)-baclofen hydrochloride

18 November 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₀H₁₃Cl₂NO₂

1 reference

Arbaclofen hydrochloride (English)

18 November 2016

canonical SMILES

C1=CC(=CC=C1C(CC(=O)O)CN)Cl.Cl

1 reference

Arbaclofen hydrochloride (English)

18 November 2016

isomeric SMILES

C1=CC(=CC=C1[C@@H](CC(=O)O)CN)Cl.Cl

1 reference

Arbaclofen hydrochloride (English)

InChI=1S/C10H12ClNO2.ClH/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14;/h1-4,8H,5-6,12H2,(H,13,14);1H/t8-;/m0./s1

18 November 2016

Identifiers

InChI

1 reference

Arbaclofen hydrochloride (English)

WMNUVYYLMCMHLU-QRPNPIFTSA-N

18 November 2016

InChIKey

1 reference

Global Substance Registration System

Arbaclofen hydrochloride (English)

18 November 2016

2 references

UNII

8703929ITD

arbaclofen hydrochloride (English)

WMNUVYYLMCMHLU-QRPNPIFTSA-N

18 November 2016

InChIKey

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=63701-55-3

1 reference

(3R)-4-Amino-3-(4-chlorophenyl)butanoic acid hydrochloride (1:1) (English)

18 November 2016

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

Arbaclofen hydrochloride (English)

18 November 2016

1 reference

DSSTOX compound identifier

0 references

1 reference

Global Substance Registration System

UNII

8703929ITD

arbaclofen hydrochloride (English)