[(E)-2-[3-[[4-[[2-(4-aminocarbonylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-3-methoxy-phenyl]methoxy]-1-phenyl-pyrazol-4-yl]ethenyl]phosphonic acid

Systemtic Name: [(E)-2-[3-[[4-[[2-(4-aminocarbonylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-3-methoxy-phenyl]methoxy]-1-phenyl-pyrazol-4-yl]ethenyl]phosphonic acid Openeye Name: [(E)-2-[3-[[4-[[2-(4-carbamoylphenyl)-5-methyl-oxazol-4-yl]methoxy]-3-methoxy-phenyl]methoxy]-1-phenyl-pyrazol-4-yl]vinyl]phosphonic acid CAS Name: [(E)-2-[3-[[4-[[2-(4-carbamoylphenyl)-5-methyl-4-oxazolyl]methoxy]-3-methoxyphenyl]methoxy]-1-phenyl-4-pyrazolyl]ethenyl]phosphonic acid IUPAC Name: [(E)-2-[3-[[4-[[2-(4-carbamoylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-3-methoxyphenyl]methoxy]-1-phenylpyrazol-4-yl]ethenyl]phosphonic acid Traditional Name: [(E)-2-[3-[4-[[2-(4-carbamoylphenyl)-5-methyl-oxazol-4-yl]methoxy]-3-methoxy-benzyl]oxy-1-phenyl-pyrazol-4-yl]vinyl]phosphonic acid Formula: C31H29N4O8P MolecularWeight: 616.557721

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)C(=O)N)COC3=C(C=C(C=C3)COC4=NN(C=C4C=CP(=O)(O)O)C5=CC=CC=C5)OC

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)C(=O)N)COC3=C(C=C(C=C3)COC4=NN(C=C4/C=C/P(=O)(O)O)C5=CC=CC=C5)OC

InChI

InChI=1S/C31H29N4O8P/c1-20-26(33-30(43-20)23-11-9-22(10-12-23)29(32)36)19-41-27-13-8-21(16-28(27)40-2)18-42-31-24(14-15-44(37,38)39)17-35(34-31)25-6-4-3-5-7-25/h3-17H,18-19H2,1-2H3,(H2,32,36)(H2,37,38,39)/b15-14+