4-[[(2,5-dimethylfuran-3-yl)carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(2,5-dimethylfuran-3-yl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(2,5-dimethylfuran-3-carbonyl)amino]methyl]benzoic acid CAS Name: 4-[[[(2,5-dimethyl-3-furanyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(2,5-dimethylfuran-3-carbonyl)amino]methyl]benzoic acid Traditional Name: 4-[[(2,5-dimethyl-3-furoyl)amino]methyl]benzoic acid Formula: C15H15NO4 MolecularWeight: 273.2839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H15NO4/c1-9-7-13(10(2)20-9)14(17)16-8-11-3-5-12(6-4-11)15(18)19/h3-7H,8H2,1-2H3,(H,16,17)(H,18,19)