[6-[4-(4-fluoranyl-3-methyl-phenyl)-6-phenyl-2-propan-2-yl-pyridin-3-yl]-1,3-bis(oxidanyl)-1-oxidanylidene-hex-5-yn-2-yl]-oxidanyl-oxidanylidene-phosphanium

Systemtic Name: [6-[4-(4-fluoranyl-3-methyl-phenyl)-6-phenyl-2-propan-2-yl-pyridin-3-yl]-1,3-bis(oxidanyl)-1-oxidanylidene-hex-5-yn-2-yl]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [1-carboxy-5-[4-(4-fluoro-3-methyl-phenyl)-2-isopropyl-6-phenyl-3-pyridyl]-2-hydroxy-pent-4-ynyl]-hydroxy-oxo-phosphonium CAS Name: [6-[4-(4-fluoro-3-methylphenyl)-6-phenyl-2-propan-2-yl-3-pyridinyl]-1,3-dihydroxy-1-oxohex-5-yn-2-yl]-hydroxy-oxophosphonium IUPAC Name: [6-[4-(4-fluoro-3-methylphenyl)-6-phenyl-2-propan-2-ylpyridin-3-yl]-1,3-dihydroxy-1-oxohex-5-yn-2-yl]-hydroxy-oxophosphanium Traditional Name: [1-carboxy-5-[4-(4-fluoro-3-methyl-phenyl)-2-isopropyl-6-phenyl-3-pyridyl]-2-hydroxy-pent-4-ynyl]-hydroxy-keto-phosphonium Formula: C27H26FNO5P+ MolecularWeight: 494.471204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=NC(=C2C#CCC(C(C(=O)O)[P+](=O)O)O)C(C)C)C3=CC=CC=C3)F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=NC(=C2C#CCC(C(C(=O)O)[P+](=O)O)O)C(C)C)C3=CC=CC=C3)F

InChI

InChI=1S/C27H24FNO5P/c1-16(2)25-20(10-7-11-24(30)26(27(31)32)35(33)34)21(19-12-13-22(28)17(3)14-19)15-23(29-25)18-8-5-4-6-9-18/h4-6,8-9,12-16,24,26,30H,11H2,1-3H3/q-1/p+2