3-[4-[[4-[[4-[(E)-2-diethoxyphosphorylethenyl]-1-phenyl-pyrazol-3-yl]oxymethyl]-2-methoxy-phenoxy]methyl]-5-methyl-1,3-oxazol-2-yl]benzoic acid

Systemtic Name: 3-[4-[[4-[[4-[(E)-2-diethoxyphosphorylethenyl]-1-phenyl-pyrazol-3-yl]oxymethyl]-2-methoxy-phenoxy]methyl]-5-methyl-1,3-oxazol-2-yl]benzoic acid Openeye Name: 3-[4-[[4-[[4-[(E)-2-diethoxyphosphorylvinyl]-1-phenyl-pyrazol-3-yl]oxymethyl]-2-methoxy-phenoxy]methyl]-5-methyl-oxazol-2-yl]benzoic acid CAS Name: 3-[4-[[4-[[4-[(E)-2-diethoxyphosphorylethenyl]-1-phenyl-3-pyrazolyl]oxymethyl]-2-methoxyphenoxy]methyl]-5-methyl-2-oxazolyl]benzoic acid IUPAC Name: 3-[4-[[4-[[4-[(E)-2-diethoxyphosphorylethenyl]-1-phenylpyrazol-3-yl]oxymethyl]-2-methoxyphenoxy]methyl]-5-methyl-1,3-oxazol-2-yl]benzoic acid Traditional Name: 3-[4-[[4-[[4-[(E)-2-diethoxyphosphorylvinyl]-1-phenyl-pyrazol-3-yl]oxymethyl]-2-methoxy-phenoxy]methyl]-5-methyl-oxazol-2-yl]benzoic acid Formula: C35H36N3O9P MolecularWeight: 673.648801

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C=CC1=CN(N=C1OCC2=CC(=C(C=C2)OCC3=C(OC(=N3)C4=CC(=CC=C4)C(=O)O)C)OC)C5=CC=CC=C5)OCC

Isomeric SMILES

CCOP(=O)(/C=C/C1=CN(N=C1OCC2=CC(=C(C=C2)OCC3=C(OC(=N3)C4=CC(=CC=C4)C(=O)O)C)OC)C5=CC=CC=C5)OCC

InChI

InChI=1S/C35H36N3O9P/c1-5-45-48(41,46-6-2)18-17-28-21-38(29-13-8-7-9-14-29)37-34(28)44-22-25-15-16-31(32(19-25)42-4)43-23-30-24(3)47-33(36-30)26-11-10-12-27(20-26)35(39)40/h7-21H,5-6,22-23H2,1-4H3,(H,39,40)/b18-17+