Atenolol acid

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Systematic / IUPAC Name: {4-[2-Hydroxy-3-(isopropylamino)propoxy]phenyl}acetic acid

ID: Reference991

Other Names: Atenolol acid;
Metoprolol acid;
4-{2-Hydroxy-3-[(1-methylethyl)amino]propoxy}benzeneacetic acid ;
Benzeneacetic acid, 4-{2-hydroxy-3-[(1-methylethyl)amino]propoxy}-

Formula: C14H21NO4

Class: Therapeutics/Prescription Drugs

Spectral Data

Atenolol acid 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 LTQ Orbitrap XL
No. of Spectral Trees 1
No. of Spectra 68
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/14/2016 9:04:07 AM
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Identificators

InChI InChI=1S/C14H21NO4/c1-10(2)15-8-12(16)9-19-13-5-3-11(4-6-13)7-14(17)18/h3-6,10,12,15-16H,7-9H2,1-2H3,(H,17,18)
InChI Key PUQIRTNPJRFRCZ-UHFFFAOYSA-N
Canonical SMILES O=C(O)Cc1ccc(OCC(O)CNC(C)C)cc1
CAS 56392144
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Other Names Atenolol acid;
Metoprolol acid;
4-{2-Hydroxy-3-[(1-methylethyl)amino]propoxy}benzeneacetic acid ;
Benzeneacetic acid, 4-{2-hydroxy-3-[(1-methylethyl)amino]propoxy}-

In Other Databases

ChemIDPlus 056392144
ChemSpider 56653
Wikipedia Atenolol
PubChem 62936