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

Systemtic Name: [3-carboxy-4-[(2-fluorophenyl)-pyridin-3-yl-methyl]-2-methyl-4-oxidanyl-hex-5-yn-3-yl]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [1-carboxy-2-[(2-fluorophenyl)-(3-pyridyl)methyl]-2-hydroxy-1-isopropyl-but-3-ynyl]-hydroxy-oxo-phosphonium CAS Name: [3-carboxy-4-[(2-fluorophenyl)-(3-pyridinyl)methyl]-4-hydroxy-2-methylhex-5-yn-3-yl]-hydroxy-oxophosphonium IUPAC Name: [3-carboxy-4-[(2-fluorophenyl)-pyridin-3-ylmethyl]-4-hydroxy-2-methylhex-5-yn-3-yl]-hydroxy-oxophosphanium Traditional Name: [1-carboxy-2-[(2-fluorophenyl)-(3-pyridyl)methyl]-2-hydroxy-1-isopropyl-but-3-ynyl]-hydroxy-keto-phosphonium Formula: C20H20FNO5P+ MolecularWeight: 404.348664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)(C(C#C)(C(C1=CN=CC=C1)C2=CC=CC=C2F)O)[P+](=O)O

Isomeric SMILES

CC(C)C(C(=O)O)(C(C#C)(C(C1=CN=CC=C1)C2=CC=CC=C2F)O)[P+](=O)O

InChI

InChI=1S/C20H18FNO5P/c1-4-19(25,20(13(2)3,18(23)24)28(26)27)17(14-8-7-11-22-12-14)15-9-5-6-10-16(15)21/h1,5-13,17,25H,2-3H3/q-1/p+2