6-fluoranyl-4-oxidanylidene-8-[[2-(3-phenylpropyl)-2,3-dihydro-1-benzofuran-5-yl]carbonylamino]chromene-2-carboxylic acid

Systemtic Name: 6-fluoranyl-4-oxidanylidene-8-[[2-(3-phenylpropyl)-2,3-dihydro-1-benzofuran-5-yl]carbonylamino]chromene-2-carboxylic acid Openeye Name: 6-fluoro-4-oxo-8-[[2-(3-phenylpropyl)-2,3-dihydrobenzofuran-5-carbonyl]amino]chromene-2-carboxylic acid CAS Name: 6-fluoro-4-oxo-8-[[oxo-[2-(3-phenylpropyl)-2,3-dihydrobenzofuran-5-yl]methyl]amino]-1-benzopyran-2-carboxylic acid IUPAC Name: 6-fluoro-4-oxo-8-[[2-(3-phenylpropyl)-2,3-dihydro-1-benzofuran-5-carbonyl]amino]chromene-2-carboxylic acid Traditional Name: 6-fluoro-4-keto-8-[[2-(3-phenylpropyl)coumaran-5-carbonyl]amino]chromene-2-carboxylic acid Formula: C28H22FNO6 MolecularWeight: 487.475783

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)C(=O)NC3=C4C(=CC(=C3)F)C(=O)C=C(O4)C(=O)O)CCCC5=CC=CC=C5

Isomeric SMILES

C1C(OC2=C1C=C(C=C2)C(=O)NC3=C4C(=CC(=C3)F)C(=O)C=C(O4)C(=O)O)CCCC5=CC=CC=C5

InChI

InChI=1S/C28H22FNO6/c29-19-13-21-23(31)15-25(28(33)34)36-26(21)22(14-19)30-27(32)17-9-10-24-18(11-17)12-20(35-24)8-4-7-16-5-2-1-3-6-16/h1-3,5-6,9-11,13-15,20H,4,7-8,12H2,(H,30,32)(H,33,34)