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3-(4-Methoxyphenyl)-3-[[2-[5-(4-methylphenyl)-2-tetrazolyl]-1-oxoethyl]amino]propanoic acid ethyl ester
SpectraBase Compound ID 5YyfdIA0gvF
InChI InChI=1S/C22H25N5O4/c1-4-31-21(29)13-19(16-9-11-18(30-3)12-10-16)23-20(28)14-27-25-22(24-26-27)17-7-5-15(2)6-8-17/h5-12,19H,4,13-14H2,1-3H3,(H,23,28)
InChIKey QLKJROJYYPOPRG-UHFFFAOYSA-N
Mol Weight 423.47 g/mol
Molecular Formula C22H25N5O4
Exact Mass 423.190654 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkXayaGW45T
Name 3-(4-Methoxyphenyl)-3-[[2-[5-(4-methylphenyl)-2-tetrazolyl]-1-oxoethyl]amino]propanoic acid ethyl ester
Alternate Name(s) Ethyl 3-(4-methoxyphenyl)-3-[2-[5-(4-methylphenyl)-1,2,3,4-tetrazol-2-yl]ethanoylamino]propanoate Ethyl 3-(4-methoxyphenyl)-3-[[2-[5-(4-methylphenyl)tetrazol-2-yl]acetyl]amino]propanoate Ethyl 3-(4-methoxyphenyl)-3-[[2-[5-(p-tolyl)tetrazol-2-yl]acetyl]amino]propanoate
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Formula C22H25N5O4
InChI InChI=1S/C22H25N5O4/c1-4-31-21(29)13-19(16-9-11-18(30-3)12-10-16)23-20(28)14-27-25-22(24-26-27)17-7-5-15(2)6-8-17/h5-12,19H,4,13-14H2,1-3H3,(H,23,28)
InChIKey QLKJROJYYPOPRG-UHFFFAOYSA-N
Molecular Weight 423.473 g/mol
SMILES N(C(=O)C[n]1nc(nn1)-c1ccc(cc1)C)C(c1ccc(cc1)OC)CC(OCC)=O
SPLASH splash10-014j-3930000000-80d67d4fcbed25d6df20
Wiley ID 1443998