[3-carboxy-4-[2-(4-fluorophenyl)-4-propan-2-yl-quinolin-3-yl]-4-oxidanyl-pent-1-yn-3-yl]-oxidanyl-oxidanylidene-phosphanium

Systemtic Name: [3-carboxy-4-[2-(4-fluorophenyl)-4-propan-2-yl-quinolin-3-yl]-4-oxidanyl-pent-1-yn-3-yl]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [1-carboxy-1-[1-[2-(4-fluorophenyl)-4-isopropyl-3-quinolyl]-1-hydroxy-ethyl]prop-2-ynyl]-hydroxy-oxo-phosphonium CAS Name: [3-carboxy-4-[2-(4-fluorophenyl)-4-propan-2-yl-3-quinolinyl]-4-hydroxypent-1-yn-3-yl]-hydroxy-oxophosphonium IUPAC Name: [3-carboxy-4-[2-(4-fluorophenyl)-4-propan-2-ylquinolin-3-yl]-4-hydroxypent-1-yn-3-yl]-hydroxy-oxophosphanium Traditional Name: [1-carboxy-1-[1-[2-(4-fluorophenyl)-4-isopropyl-3-quinolyl]-1-hydroxy-ethyl]prop-2-ynyl]-hydroxy-keto-phosphonium Formula: C24H22FNO5P+ MolecularWeight: 454.407344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)F)C(C)(C(C#C)(C(=O)O)[P+](=O)O)O

Isomeric SMILES

CC(C)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)F)C(C)(C(C#C)(C(=O)O)[P+](=O)O)O

InChI

InChI=1S/C24H20FNO5P/c1-5-24(22(27)28,32(30)31)23(4,29)20-19(14(2)3)17-8-6-7-9-18(17)26-21(20)15-10-12-16(25)13-11-15/h1,6-14,29H,2-4H3/q-1/p+2