[3-carboxy-4-[(4-fluoranyl-2-methyl-phenyl)-(6-phenylpyridin-3-yl)methyl]-2-methyl-4-oxidanyl-hex-5-en-3-yl]-methoxy-oxidanylidene-phosphanium

Systemtic Name: [3-carboxy-4-[(4-fluoranyl-2-methyl-phenyl)-(6-phenylpyridin-3-yl)methyl]-2-methyl-4-oxidanyl-hex-5-en-3-yl]-methoxy-oxidanylidene-phosphanium Openeye Name: [1-carboxy-2-[(4-fluoro-2-methyl-phenyl)-(6-phenyl-3-pyridyl)methyl]-2-hydroxy-1-isopropyl-but-3-enyl]-methoxy-oxo-phosphonium CAS Name: [3-carboxy-4-[(4-fluoro-2-methylphenyl)-(6-phenyl-3-pyridinyl)methyl]-4-hydroxy-2-methylhex-5-en-3-yl]-methoxy-oxophosphonium IUPAC Name: [3-carboxy-4-[(4-fluoro-2-methylphenyl)-(6-phenylpyridin-3-yl)methyl]-4-hydroxy-2-methylhex-5-en-3-yl]-methoxy-oxophosphanium Traditional Name: [1-carboxy-2-[(4-fluoro-2-methyl-phenyl)-(6-phenyl-3-pyridyl)methyl]-2-hydroxy-1-isopropyl-but-3-enyl]-keto-methoxy-phosphonium Formula: C28H30FNO5P+ MolecularWeight: 510.513664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C(C2=CN=C(C=C2)C3=CC=CC=C3)C(C=C)(C(C(C)C)(C(=O)O)[P+](=O)OC)O

Isomeric SMILES

CC1=C(C=CC(=C1)F)C(C2=CN=C(C=C2)C3=CC=CC=C3)C(C=C)(C(C(C)C)(C(=O)O)[P+](=O)OC)O

InChI

InChI=1S/C28H29FNO5P/c1-6-27(33,28(18(2)3,26(31)32)36(34)35-5)25(23-14-13-22(29)16-19(23)4)21-12-15-24(30-17-21)20-10-8-7-9-11-20/h6-18,25,33H,1H2,2-5H3/p+1