Systematic / IUPAC Name: (3S)-2-((2R)-2-{[(2R)-1-Ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
ID: Reference7589
Other Names:
(3S)-2-{N-[(2R)-1-Ethoxy-1-oxo-4-phenyl-2-butanyl]-D-alanyl}-6,7-dimethoxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid;
3-Isoquinolinecarboxylic acid, 2-[(2R)-2-[[(1R)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-1,2,3,4-tetrahydro-6,7-dimethoxy, (3S)-
Formula: C27H34N2O7
Class: Therapeutics/Prescription Drugs Sports Doping Drugs
Moexipril mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 1 |
No. of Spectra | 109 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 3/20/2018 1:37:46 PM |
InChI | InChI=1S/C27H34N2O7/c1-5-36-27(33)21(12-11-18-9-7-6-8-10-18)28-17(2)25(30)29-16-20-15-24(35-4)23(34-3)14-19(20)13-22(29)26(31)32/h6-10,14-15,17,21-22,28H,5,11-13,16H2,1-4H3,(H,31,32)/t17-,21-,22+/m1/s1 |
InChI Key | UWWDHYUMIORJTA-YHYVQYDKSA-N |
Canonical SMILES | CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CC3=CC(=C(C=C3CC2C(=O)O)OC)OC |
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Other Names |
(3S)-2-{N-[(2R)-1-Ethoxy-1-oxo-4-phenyl-2-butanyl]-D-alanyl}-6,7-dimethoxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid; 3-Isoquinolinecarboxylic acid, 2-[(2R)-2-[[(1R)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-1,2,3,4-tetrahydro-6,7-dimethoxy, (3S)- |