[2,4-bis(oxidanyl)-4-oxidanylidene-butyl]-[3-[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenyl-pyridin-3-yl]prop-2-ynoxy]-oxidanylidene-phosphanium

Systemtic Name: [2,4-bis(oxidanyl)-4-oxidanylidene-butyl]-[3-[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenyl-pyridin-3-yl]prop-2-ynoxy]-oxidanylidene-phosphanium Openeye Name: 3-[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenyl-3-pyridyl]prop-2-ynoxy-(2,4-dihydroxy-4-oxo-butyl)-oxo-phosphonium CAS Name: 3-[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenyl-3-pyridinyl]prop-2-ynoxy-(2,4-dihydroxy-4-oxobutyl)-oxophosphonium IUPAC Name: 3-[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenylpyridin-3-yl]prop-2-ynoxy-(2,4-dihydroxy-4-oxobutyl)-oxophosphanium Traditional Name: 3-[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenyl-3-pyridyl]prop-2-ynoxy-(2,4-dihydroxy-4-keto-butyl)-keto-phosphonium Formula: C28H26FNO5P+ MolecularWeight: 506.481904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C2=CC=C(C=C2)F)C#CCO[P+](=O)CC(CC(=O)O)O)C3CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(C(=C1C2=CC=C(C=C2)F)C#CCO[P+](=O)CC(CC(=O)O)O)C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C28H25FNO5P/c1-18-26(19-11-13-22(29)14-12-19)24(8-5-15-35-36(34)17-23(31)16-25(32)33)28(21-9-10-21)30-27(18)20-6-3-2-4-7-20/h2-4,6-7,11-14,21,23,31H,9-10,15-17H2,1H3/p+1