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

Systemtic Name: 4-[(2,4,5-trimethylfuran-3-yl)carbonylamino]butanoic acid Openeye Name: 4-[(2,4,5-trimethylfuran-3-carbonyl)amino]butanoic acid CAS Name: 4-[[oxo-(2,4,5-trimethyl-3-furanyl)methyl]amino]butanoic acid IUPAC Name: 4-[(2,4,5-trimethylfuran-3-carbonyl)amino]butanoic acid Traditional Name: 4-[(2,4,5-trimethyl-3-furoyl)amino]butyric acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO4/c1-7-8(2)17-9(3)11(7)12(16)13-6-4-5-10(14)15/h4-6H2,1-3H3,(H,13,16)(H,14,15)