5-[[[5-[(4-fluoranylphenoxy)methyl]furan-2-yl]carbonylamino]methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[[[5-[(4-fluoranylphenoxy)methyl]furan-2-yl]carbonylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[[5-[(4-fluorophenoxy)methyl]furan-2-carbonyl]amino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[[5-[(4-fluorophenoxy)methyl]-2-furanyl]-oxomethyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[[5-[(4-fluorophenoxy)methyl]furan-2-carbonyl]amino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[[5-[(4-fluorophenoxy)methyl]-2-furoyl]amino]methyl]-2-methoxy-benzoic acid Formula: C21H18FNO6 MolecularWeight: 399.369123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC=C(O2)COC3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC=C(O2)COC3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C21H18FNO6/c1-27-18-8-2-13(10-17(18)21(25)26)11-23-20(24)19-9-7-16(29-19)12-28-15-5-3-14(22)4-6-15/h2-10H,11-12H2,1H3,(H,23,24)(H,25,26)