[3-carboxy-4-[(6-cyclopropylpyridin-3-yl)-(4-fluorophenyl)methyl]-2-methyl-4-oxidanyl-hex-5-yn-3-yl]-oxidanyl-oxidanylidene-phosphanium

Systemtic Name: [3-carboxy-4-[(6-cyclopropylpyridin-3-yl)-(4-fluorophenyl)methyl]-2-methyl-4-oxidanyl-hex-5-yn-3-yl]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [1-carboxy-2-[(6-cyclopropyl-3-pyridyl)-(4-fluorophenyl)methyl]-2-hydroxy-1-isopropyl-but-3-ynyl]-hydroxy-oxo-phosphonium CAS Name: [3-carboxy-4-[(6-cyclopropyl-3-pyridinyl)-(4-fluorophenyl)methyl]-4-hydroxy-2-methylhex-5-yn-3-yl]-hydroxy-oxophosphonium IUPAC Name: [3-carboxy-4-[(6-cyclopropylpyridin-3-yl)-(4-fluorophenyl)methyl]-4-hydroxy-2-methylhex-5-yn-3-yl]-hydroxy-oxophosphanium Traditional Name: [1-carboxy-2-[(6-cyclopropyl-3-pyridyl)-(4-fluorophenyl)methyl]-2-hydroxy-1-isopropyl-but-3-ynyl]-hydroxy-keto-phosphonium Formula: C23H24FNO5P+ MolecularWeight: 444.412524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)(C(C#C)(C(C1=CC=C(C=C1)F)C2=CN=C(C=C2)C3CC3)O)[P+](=O)O

Isomeric SMILES

CC(C)C(C(=O)O)(C(C#C)(C(C1=CC=C(C=C1)F)C2=CN=C(C=C2)C3CC3)O)[P+](=O)O

InChI

InChI=1S/C23H22FNO5P/c1-4-22(28,23(14(2)3,21(26)27)31(29)30)20(16-7-10-18(24)11-8-16)17-9-12-19(25-13-17)15-5-6-15/h1,7-15,20,28H,5-6H2,2-3H3/q-1/p+2