3-[7-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-4-methyl-2-oxidanylidene-chromen-3-yl]propanoic acid

Systemtic Name: 3-[7-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-4-methyl-2-oxidanylidene-chromen-3-yl]propanoic acid Openeye Name: 3-[7-[(2-chloro-4-fluoro-phenyl)methoxy]-4-methyl-2-oxo-chromen-3-yl]propanoic acid CAS Name: 3-[7-[(2-chloro-4-fluorophenyl)methoxy]-4-methyl-2-oxo-1-benzopyran-3-yl]propanoic acid IUPAC Name: 3-[7-[(2-chloro-4-fluorophenyl)methoxy]-4-methyl-2-oxochromen-3-yl]propanoic acid Traditional Name: 3-[7-(2-chloro-4-fluoro-benzyl)oxy-2-keto-4-methyl-chromen-3-yl]propionic acid Formula: C20H16ClFO5 MolecularWeight: 390.789443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=C(C=C(C=C3)F)Cl)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=C(C=C(C=C3)F)Cl)CCC(=O)O

InChI

InChI=1S/C20H16ClFO5/c1-11-15-5-4-14(26-10-12-2-3-13(22)8-17(12)21)9-18(15)27-20(25)16(11)6-7-19(23)24/h2-5,8-9H,6-7,10H2,1H3,(H,23,24)