(phenylmethyl) 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoate

Systemtic Name: (phenylmethyl) 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoate Openeye Name: benzyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoate CAS Name: 2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-(4-iodophenyl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoate Traditional Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propionic acid benzyl ester Formula: C31H26INO4 MolecularWeight: 603.44691

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC2=CC=C(C=C2)I)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CC2=CC=C(C=C2)I)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C31H26INO4/c32-23-16-14-21(15-17-23)18-29(30(34)36-19-22-8-2-1-3-9-22)33-31(35)37-20-28-26-12-6-4-10-24(26)25-11-5-7-13-27(25)28/h1-17,28-29H,18-20H2,(H,33,35)