3-[4-(4-fluorophenyl)-1-oxidanylidene-phthalazin-2-yl]propanoic acid

Systemtic Name: 3-[4-(4-fluorophenyl)-1-oxidanylidene-phthalazin-2-yl]propanoic acid Openeye Name: 3-[4-(4-fluorophenyl)-1-oxo-phthalazin-2-yl]propanoic acid CAS Name: 3-[4-(4-fluorophenyl)-1-oxo-2-phthalazinyl]propanoic acid IUPAC Name: 3-[4-(4-fluorophenyl)-1-oxophthalazin-2-yl]propanoic acid Traditional Name: 3-[4-(4-fluorophenyl)-1-keto-phthalazin-2-yl]propionic acid Formula: C17H13FN2O3 MolecularWeight: 312.295123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CCC(=O)O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CCC(=O)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H13FN2O3/c18-12-7-5-11(6-8-12)16-13-3-1-2-4-14(13)17(23)20(19-16)10-9-15(21)22/h1-8H,9-10H2,(H,21,22)