2-[(2,4,5-trimethylfuran-3-yl)carbonylamino]propanoic acid

Systemtic Name: 2-[(2,4,5-trimethylfuran-3-yl)carbonylamino]propanoic acid Openeye Name: 2-[(2,4,5-trimethylfuran-3-carbonyl)amino]propanoic acid CAS Name: 2-[[oxo-(2,4,5-trimethyl-3-furanyl)methyl]amino]propanoic acid IUPAC Name: 2-[(2,4,5-trimethylfuran-3-carbonyl)amino]propanoic acid Traditional Name: 2-[(2,4,5-trimethyl-3-furoyl)amino]propionic acid Formula: C11H15NO4 MolecularWeight: 225.2411

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C(=O)NC(C)C(=O)O)C)C

Isomeric SMILES

CC1=C(OC(=C1C(=O)NC(C)C(=O)O)C)C

InChI

InChI=1S/C11H15NO4/c1-5-7(3)16-8(4)9(5)10(13)12-6(2)11(14)15/h6H,1-4H3,(H,12,13)(H,14,15)