Clanobutin

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Systematic / IUPAC Name: 4-[(4-Chlorobenzoyl)(4-methoxyphenyl)amino]butanoic acid

ID: Reference1983

Other Names: Clanobutine;
Bykahepar;
4-(p-Chloro-N-(p-methoxyphenyl)benzamido)butyric acid;
4-((4-Chlorobenzoyl)(4-methoxyphenyl)amino)butanoic acid;
Butyric acid, 4-(p-chloro-N-(p-methoxyphenyl)benzamido)- ; more

Formula: C18H18ClNO4

Class: Therapeutics/Prescription Drugs

Spectral Data

Clanobutin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 45
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/13/2015 12:43:31 PM
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Identificators

InChI InChI=1S/C18H18ClNO4/c1-24-16-10-8-15(9-11-16)20(12-2-3-17(21)22)18(23)13-4-6-14(19)7-5-13/h4-11H,2-3,12H2,1H3,(H,21,22)
InChI Key VUPBWNXFSDRWJE-UHFFFAOYSA-N
Canonical SMILES COC1=CC=C(C=C1)N(CCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl
CAS
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Other Names Clanobutine;
Bykahepar;
4-(p-Chloro-N-(p-methoxyphenyl)benzamido)butyric acid;
4-((4-Chlorobenzoyl)(4-methoxyphenyl)amino)butanoic acid;
Butyric acid, 4-(p-chloro-N-(p-methoxyphenyl)benzamido)-;
Butanoic acid, 4-[(4-chlorobenzoyl)(4-methoxyphenyl)amino]-;
N-(p-Chlorobenzoyl)-Υ-(p-anisidino) butyric acid

In Other Databases

ChEMBL CHEMBL2107589
KEGG D07708
ChemSpider 32563
ChemIDPlus 030544617; 074755218
PubChem 35378