2-[(E)-2-(4-fluorophenyl)ethenyl]-4-oxidanylidene-3-propyl-chromene-6-carboxylic acid

Systemtic Name: 2-[(E)-2-(4-fluorophenyl)ethenyl]-4-oxidanylidene-3-propyl-chromene-6-carboxylic acid Openeye Name: 2-[(E)-2-(4-fluorophenyl)vinyl]-4-oxo-3-propyl-chromene-6-carboxylic acid CAS Name: 2-[(E)-2-(4-fluorophenyl)ethenyl]-4-oxo-3-propyl-1-benzopyran-6-carboxylic acid IUPAC Name: 2-[(E)-2-(4-fluorophenyl)ethenyl]-4-oxo-3-propylchromene-6-carboxylic acid Traditional Name: 2-[(E)-2-(4-fluorophenyl)vinyl]-4-keto-3-propyl-chromene-6-carboxylic acid Formula: C21H17FO4 MolecularWeight: 352.355683

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)O)C=CC3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)O)/C=C/C3=CC=C(C=C3)F

InChI

InChI=1S/C21H17FO4/c1-2-3-16-18(10-6-13-4-8-15(22)9-5-13)26-19-11-7-14(21(24)25)12-17(19)20(16)23/h4-12H,2-3H2,1H3,(H,24,25)/b10-6+