(3-iodanyl-4-methoxy-phenyl) 3-[2-(methylamino)-4-oxidanylidene-5-phenyl-furan-3-yl]benzoate

Systemtic Name: (3-iodanyl-4-methoxy-phenyl) 3-[2-(methylamino)-4-oxidanylidene-5-phenyl-furan-3-yl]benzoate Openeye Name: (3-iodo-4-methoxy-phenyl) 3-[2-(methylamino)-4-oxo-5-phenyl-3-furyl]benzoate CAS Name: 3-[2-(methylamino)-4-oxo-5-phenyl-3-furanyl]benzoic acid (3-iodo-4-methoxyphenyl) ester IUPAC Name: (3-iodo-4-methoxyphenyl) 3-[2-(methylamino)-4-oxo-5-phenylfuran-3-yl]benzoate Traditional Name: 3-[4-keto-2-(methylamino)-5-phenyl-3-furyl]benzoic acid (3-iodo-4-methoxy-phenyl) ester Formula: C25H20INO5 MolecularWeight: 541.33447

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(=O)OC4=CC(=C(C=C4)OC)I

Isomeric SMILES

CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(=O)OC4=CC(=C(C=C4)OC)I

InChI

InChI=1S/C25H20INO5/c1-27-24-21(22(28)23(32-24)15-7-4-3-5-8-15)16-9-6-10-17(13-16)25(29)31-18-11-12-20(30-2)19(26)14-18/h3-14,23,27H,1-2H3