methyl (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-1-pentanoylpyrrolidin-2-yl]carbonylamino]propanoate

Systemtic Name: methyl (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-1-pentanoylpyrrolidin-2-yl]carbonylamino]propanoate Openeye Name: methyl (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-1-pentanoylpyrrolidine-2-carbonyl]amino]propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[[oxo-[(2S)-1-(1-oxopentyl)-2-pyrrolidinyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-1-pentanoylpyrrolidine-2-carbonyl]amino]propanoate Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-1-valerylprolyl]amino]propionic acid methyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCCC1C(=O)NC(CC2=CC=C(C=C2)O)C(=O)OC

Isomeric SMILES

CCCCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)OC

InChI

InChI=1S/C20H28N2O5/c1-3-4-7-18(24)22-12-5-6-17(22)19(25)21-16(20(26)27-2)13-14-8-10-15(23)11-9-14/h8-11,16-17,23H,3-7,12-13H2,1-2H3,(H,21,25)/t16-,17-/m0/s1