[2,4-bis(oxidanyl)-4-oxidanylidene-butyl]-[3-[5-ethyl-4-(4-fluorophenyl)-6-phenyl-2-propan-2-yl-pyridin-3-yl]propoxy]-oxidanylidene-phosphanium

Systemtic Name: [2,4-bis(oxidanyl)-4-oxidanylidene-butyl]-[3-[5-ethyl-4-(4-fluorophenyl)-6-phenyl-2-propan-2-yl-pyridin-3-yl]propoxy]-oxidanylidene-phosphanium Openeye Name: (2,4-dihydroxy-4-oxo-butyl)-[3-[5-ethyl-4-(4-fluorophenyl)-2-isopropyl-6-phenyl-3-pyridyl]propoxy]-oxo-phosphonium CAS Name: (2,4-dihydroxy-4-oxobutyl)-[3-[5-ethyl-4-(4-fluorophenyl)-6-phenyl-2-propan-2-yl-3-pyridinyl]propoxy]-oxophosphonium IUPAC Name: (2,4-dihydroxy-4-oxobutyl)-[3-[5-ethyl-4-(4-fluorophenyl)-6-phenyl-2-propan-2-ylpyridin-3-yl]propoxy]-oxophosphanium Traditional Name: (2,4-dihydroxy-4-keto-butyl)-[3-[5-ethyl-4-(4-fluorophenyl)-2-isopropyl-6-phenyl-3-pyridyl]propoxy]-keto-phosphonium Formula: C29H34FNO5P+ MolecularWeight: 526.556124

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N=C1C2=CC=CC=C2)C(C)C)CCCO[P+](=O)CC(CC(=O)O)O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=C(C(=C(N=C1C2=CC=CC=C2)C(C)C)CCCO[P+](=O)CC(CC(=O)O)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C29H33FNO5P/c1-4-24-27(20-12-14-22(30)15-13-20)25(11-8-16-36-37(35)18-23(32)17-26(33)34)28(19(2)3)31-29(24)21-9-6-5-7-10-21/h5-7,9-10,12-15,19,23,32H,4,8,11,16-18H2,1-3H3/p+1