3-[furan-3-ylcarbonyl(hexyl)amino]propanoic acid

Systemtic Name: 3-[furan-3-ylcarbonyl(hexyl)amino]propanoic acid Openeye Name: 3-[furan-3-carbonyl(hexyl)amino]propanoic acid CAS Name: 3-[[3-furanyl(oxo)methyl]-hexylamino]propanoic acid IUPAC Name: 3-[furan-3-carbonyl(hexyl)amino]propanoic acid Traditional Name: 3-[3-furoyl(hexyl)amino]propionic acid Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCC(=O)O)C(=O)C1=COC=C1

Isomeric SMILES

CCCCCCN(CCC(=O)O)C(=O)C1=COC=C1

InChI

InChI=1S/C14H21NO4/c1-2-3-4-5-8-15(9-6-13(16)17)14(18)12-7-10-19-11-12/h7,10-11H,2-6,8-9H2,1H3,(H,16,17)