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

Systemtic Name: 5-[3-(6-bromanyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(2,3-dimethoxyphenyl)pyrazolidin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3-(6-bromo-2-oxo-4-phenyl-3-quinolylidene)-5-(2,3-dimethoxyphenyl)pyrazolidin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[3-(6-bromo-2-oxo-4-phenyl-3-quinolinylidene)-5-(2,3-dimethoxyphenyl)-1-pyrazolidinyl]-5-oxopentanoic acid IUPAC Name: 5-[3-(6-bromo-2-oxo-4-phenylquinolin-3-ylidene)-5-(2,3-dimethoxyphenyl)pyrazolidin-1-yl]-5-oxopentanoic acid Traditional Name: 5-[3-(6-bromo-2-keto-4-phenyl-3-quinolylidene)-5-(2,3-dimethoxyphenyl)pyrazolidin-1-yl]-5-keto-valeric acid Formula: C31H28BrN3O6 MolecularWeight: 618.47452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2CC(=C3C(=C4C=C(C=CC4=NC3=O)Br)C5=CC=CC=C5)NN2C(=O)CCCC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)C2CC(=C3C(=C4C=C(C=CC4=NC3=O)Br)C5=CC=CC=C5)NN2C(=O)CCCC(=O)O

InChI

InChI=1S/C31H28BrN3O6/c1-40-25-11-6-10-20(30(25)41-2)24-17-23(34-35(24)26(36)12-7-13-27(37)38)29-28(18-8-4-3-5-9-18)21-16-19(32)14-15-22(21)33-31(29)39/h3-6,8-11,14-16,24,34H,7,12-13,17H2,1-2H3,(H,37,38)