[3-carboxy-4-[4-(4-fluoranyl-2-methyl-phenyl)-6-phenyl-2-propan-2-yl-pyridin-3-yl]-4-oxidanyl-pent-1-yn-3-yl]-methoxy-oxidanylidene-phosphanium

Systemtic Name: [3-carboxy-4-[4-(4-fluoranyl-2-methyl-phenyl)-6-phenyl-2-propan-2-yl-pyridin-3-yl]-4-oxidanyl-pent-1-yn-3-yl]-methoxy-oxidanylidene-phosphanium Openeye Name: [1-carboxy-1-[1-[4-(4-fluoro-2-methyl-phenyl)-2-isopropyl-6-phenyl-3-pyridyl]-1-hydroxy-ethyl]prop-2-ynyl]-methoxy-oxo-phosphonium CAS Name: [3-carboxy-4-[4-(4-fluoro-2-methylphenyl)-6-phenyl-2-propan-2-yl-3-pyridinyl]-4-hydroxypent-1-yn-3-yl]-methoxy-oxophosphonium IUPAC Name: [3-carboxy-4-[4-(4-fluoro-2-methylphenyl)-6-phenyl-2-propan-2-ylpyridin-3-yl]-4-hydroxypent-1-yn-3-yl]-methoxy-oxophosphanium Traditional Name: [1-carboxy-1-[1-[4-(4-fluoro-2-methyl-phenyl)-2-isopropyl-6-phenyl-3-pyridyl]-1-hydroxy-ethyl]prop-2-ynyl]-keto-methoxy-phosphonium Formula: C28H28FNO5P+ MolecularWeight: 508.497784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H27FNO5P/c1-7-28(26(31)32,36(34)35-6)27(5,33)24-22(21-14-13-20(29)15-18(21)4)16-23(30-25(24)17(2)3)19-11-9-8-10-12-19/h1,8-17,33H,2-6H3/p+1