(phenylmethyl) 2-(4-iodophenyl)-2-(phenylmethoxycarbonylamino)ethanoate

Systemtic Name: (phenylmethyl) 2-(4-iodophenyl)-2-(phenylmethoxycarbonylamino)ethanoate Openeye Name: benzyl 2-(benzyloxycarbonylamino)-2-(4-iodophenyl)acetate CAS Name: 2-(4-iodophenyl)-2-(phenylmethoxycarbonylamino)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(4-iodophenyl)-2-(phenylmethoxycarbonylamino)acetate Traditional Name: 2-(benzyloxycarbonylamino)-2-(4-iodophenyl)acetic acid benzyl ester Formula: C23H20INO4 MolecularWeight: 501.31367

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(C2=CC=C(C=C2)I)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(C2=CC=C(C=C2)I)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H20INO4/c24-20-13-11-19(12-14-20)21(22(26)28-15-17-7-3-1-4-8-17)25-23(27)29-16-18-9-5-2-6-10-18/h1-14,21H,15-16H2,(H,25,27)