2-[(2,5-dimethylfuran-3-yl)carbonyl-methyl-amino]benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)N(C)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)N(C)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H15NO4/c1-9-8-12(10(2)20-9)14(17)16(3)13-7-5-4-6-11(13)15(18)19/h4-8H,1-3H3,(H,18,19)