5-[3-(6-bromanyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(2-fluorophenyl)pyrazolidin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[3-(6-bromanyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(2-fluorophenyl)pyrazolidin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3-(6-bromo-2-oxo-4-phenyl-3-quinolylidene)-5-(2-fluorophenyl)pyrazolidin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[3-(6-bromo-2-oxo-4-phenyl-3-quinolinylidene)-5-(2-fluorophenyl)-1-pyrazolidinyl]-5-oxopentanoic acid IUPAC Name: 5-[3-(6-bromo-2-oxo-4-phenylquinolin-3-ylidene)-5-(2-fluorophenyl)pyrazolidin-1-yl]-5-oxopentanoic acid Traditional Name: 5-[3-(6-bromo-2-keto-4-phenyl-3-quinolylidene)-5-(2-fluorophenyl)pyrazolidin-1-yl]-5-keto-valeric acid Formula: C29H23BrFN3O4 MolecularWeight: 576.413023

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(NC1=C2C(=C3C=C(C=CC3=NC2=O)Br)C4=CC=CC=C4)C(=O)CCCC(=O)O)C5=CC=CC=C5F

Isomeric SMILES

C1C(N(NC1=C2C(=C3C=C(C=CC3=NC2=O)Br)C4=CC=CC=C4)C(=O)CCCC(=O)O)C5=CC=CC=C5F

InChI

InChI=1S/C29H23BrFN3O4/c30-18-13-14-22-20(15-18)27(17-7-2-1-3-8-17)28(29(38)32-22)23-16-24(19-9-4-5-10-21(19)31)34(33-23)25(35)11-6-12-26(36)37/h1-5,7-10,13-15,24,33H,6,11-12,16H2,(H,36,37)