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

Systemtic Name: 4-[[(2,5-dimethylfuran-3-yl)-methanoyl-amino]methyl]benzoic acid Openeye Name: 4-[[(2,5-dimethyl-3-furyl)-formyl-amino]methyl]benzoic acid CAS Name: 4-[[(2,5-dimethyl-3-furanyl)-formylamino]methyl]benzoic acid IUPAC Name: 4-[[(2,5-dimethylfuran-3-yl)-formylamino]methyl]benzoic acid Traditional Name: 4-[[(2,5-dimethyl-3-furyl)-formyl-amino]methyl]benzoic acid Formula: C15H15NO4 MolecularWeight: 273.2839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)N(CC2=CC=C(C=C2)C(=O)O)C=O

Isomeric SMILES

CC1=CC(=C(O1)C)N(CC2=CC=C(C=C2)C(=O)O)C=O

InChI

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