[(4-bromophenyl)-[5-(2-hydroxyphenyl)-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl]methyl]phosphonic acid

Systemtic Name: [(4-bromophenyl)-[5-(2-hydroxyphenyl)-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl]methyl]phosphonic acid Openeye Name: [(4-bromophenyl)-[5-(2-hydroxyphenyl)-3-oxo-2-phenyl-1H-pyrazol-4-yl]methyl]phosphonic acid CAS Name: [(4-bromophenyl)-[5-(2-hydroxyphenyl)-3-oxo-2-phenyl-1H-pyrazol-4-yl]methyl]phosphonic acid IUPAC Name: [(4-bromophenyl)-[5-(2-hydroxyphenyl)-3-oxo-2-phenyl-1H-pyrazol-4-yl]methyl]phosphonic acid Traditional Name: [(4-bromophenyl)-[3-(2-hydroxyphenyl)-5-keto-1-phenyl-3-pyrazolin-4-yl]methyl]phosphonic acid Formula: C22H18BrN2O5P MolecularWeight: 501.266481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=C(N2)C3=CC=CC=C3O)C(C4=CC=C(C=C4)Br)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=C(N2)C3=CC=CC=C3O)C(C4=CC=C(C=C4)Br)P(=O)(O)O

InChI

InChI=1S/C22H18BrN2O5P/c23-15-12-10-14(11-13-15)21(31(28,29)30)19-20(17-8-4-5-9-18(17)26)24-25(22(19)27)16-6-2-1-3-7-16/h1-13,21,24,26H,(H2,28,29,30)