5-[(3E)-5-(3-bromophenyl)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)pyrazolidin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(3E)-5-(3-bromophenyl)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)pyrazolidin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(3E)-5-(3-bromophenyl)-3-(6-chloro-2-oxo-4-phenyl-3-quinolylidene)pyrazolidin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[(3E)-5-(3-bromophenyl)-3-(6-chloro-2-oxo-4-phenyl-3-quinolinylidene)-1-pyrazolidinyl]-5-oxopentanoic acid IUPAC Name: 5-[(3E)-5-(3-bromophenyl)-3-(6-chloro-2-oxo-4-phenylquinolin-3-ylidene)pyrazolidin-1-yl]-5-oxopentanoic acid Traditional Name: 5-[(3E)-5-(3-bromophenyl)-3-(6-chloro-2-keto-4-phenyl-3-quinolylidene)pyrazolidin-1-yl]-5-keto-valeric acid Formula: C29H23BrClN3O4 MolecularWeight: 592.86762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C\1C(N(N/C1=C/2\C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)C(=O)CCCC(=O)O)C5=CC(=CC=C5)Br

InChI

InChI=1S/C29H23BrClN3O4/c30-19-9-4-8-18(14-19)24-16-23(33-34(24)25(35)10-5-11-26(36)37)28-27(17-6-2-1-3-7-17)21-15-20(31)12-13-22(21)32-29(28)38/h1-4,6-9,12-15,24,33H,5,10-11,16H2,(H,36,37)/b28-23+