[4-[3-(4-fluoranylphenoxy)phenyl]but-3-yn-2-yl-phenylmethoxycarbonyl-amino] (phenylmethyl) carbonate

Systemtic Name: [4-[3-(4-fluoranylphenoxy)phenyl]but-3-yn-2-yl-phenylmethoxycarbonyl-amino] (phenylmethyl) carbonate Openeye Name: benzyl [benzyloxycarbonyl-[3-[3-(4-fluorophenoxy)phenyl]-1-methyl-prop-2-ynyl]amino] carbonate CAS Name: carbonic acid [4-[3-(4-fluorophenoxy)phenyl]but-3-yn-2-yl-phenylmethoxycarbonylamino] (phenylmethyl) ester IUPAC Name: benzyl [4-[3-(4-fluorophenoxy)phenyl]but-3-yn-2-yl-phenylmethoxycarbonylamino] carbonate Traditional Name: carbonic acid benzyl [carbobenzoxy-[3-[3-(4-fluorophenoxy)phenyl]-1-methyl-prop-2-ynyl]amino] ester Formula: C32H26FNO6 MolecularWeight: 539.550343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC(=CC=C1)OC2=CC=C(C=C2)F)N(C(=O)OCC3=CC=CC=C3)OC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C#CC1=CC(=CC=C1)OC2=CC=C(C=C2)F)N(C(=O)OCC3=CC=CC=C3)OC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C32H26FNO6/c1-24(15-16-25-13-8-14-30(21-25)39-29-19-17-28(33)18-20-29)34(31(35)37-22-26-9-4-2-5-10-26)40-32(36)38-23-27-11-6-3-7-12-27/h2-14,17-21,24H,22-23H2,1H3