disodium (3R)-4-[[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenyl-pyridin-3-yl]methoxy-oxidanidyl-phosphoryl]-3-oxidanyl-butanoate

Systemtic Name: disodium (3R)-4-[[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenyl-pyridin-3-yl]methoxy-oxidanidyl-phosphoryl]-3-oxidanyl-butanoate Openeye Name: disodium (3R)-4-[[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenyl-3-pyridyl]methoxy-oxido-phosphoryl]-3-hydroxy-butanoate CAS Name: disodium (3R)-4-[[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenyl-3-pyridinyl]methoxy-oxidophosphoryl]-3-hydroxybutanoate IUPAC Name: disodium (3R)-4-[[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenylpyridin-3-yl]methoxy-oxidophosphoryl]-3-hydroxybutanoate Traditional Name: disodium (3R)-4-[[2-cyclopropyl-4-(4-fluorophenyl)-5-methyl-6-phenyl-3-pyridyl]methoxy-oxido-phosphoryl]-3-hydroxy-butyrate Formula: C26H25FNNa2O6P MolecularWeight: 543.431504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N=C1C2=CC=CC=C2)C3CC3)COP(=O)(CC(CC(=O)[O-])O)[O-])C4=CC=C(C=C4)F.[Na+].[Na+]

Isomeric SMILES

CC1=C(C(=C(N=C1C2=CC=CC=C2)C3CC3)COP(=O)(C[C@@H](CC(=O)[O-])O)[O-])C4=CC=C(C=C4)F.[Na+].[Na+]

InChI

InChI=1S/C26H27FNO6P.2Na/c1-16-24(17-9-11-20(27)12-10-17)22(14-34-35(32,33)15-21(29)13-23(30)31)26(19-7-8-19)28-25(16)18-5-3-2-4-6-18;;/h2-6,9-12,19,21,29H,7-8,13-15H2,1H3,(H,30,31)(H,32,33);;/q;2*+1/p-2/t21-;;/m1../s1