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

Systemtic Name: 4-[4-[[2-methoxy-4-[[1-phenyl-4-[(E)-2-phosphonatoethenyl]pyrazol-3-yl]oxymethyl]phenoxy]methyl]-5-methyl-1,3-oxazol-2-yl]benzamide Openeye Name: 4-[4-[[2-methoxy-4-[[1-phenyl-4-[(E)-2-phosphonatovinyl]pyrazol-3-yl]oxymethyl]phenoxy]methyl]-5-methyl-oxazol-2-yl]benzamide CAS Name: 4-[4-[[2-methoxy-4-[[1-phenyl-4-[(E)-2-phosphonatoethenyl]-3-pyrazolyl]oxymethyl]phenoxy]methyl]-5-methyl-2-oxazolyl]benzamide IUPAC Name: 4-[4-[[2-methoxy-4-[[1-phenyl-4-[(E)-2-phosphonatoethenyl]pyrazol-3-yl]oxymethyl]phenoxy]methyl]-5-methyl-1,3-oxazol-2-yl]benzamide Traditional Name: 4-[4-[[2-methoxy-4-[[1-phenyl-4-[(E)-2-phosphonatovinyl]pyrazol-3-yl]oxymethyl]phenoxy]methyl]-5-methyl-oxazol-2-yl]benzamide Formula: C31H27N4O8P-2 MolecularWeight: 614.541841

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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)/p-2/b15-14+