(phenylmethyl) 4-[4-cyano-3-[2-[(4-iodophenyl)sulfonylamino]propoxy]-2-phenyl-phenoxy]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[4-cyano-3-[2-[(4-iodophenyl)sulfonylamino]propoxy]-2-phenyl-phenoxy]piperidine-1-carboxylate Openeye Name: benzyl 4-[4-cyano-3-[2-[(4-iodophenyl)sulfonylamino]propoxy]-2-phenyl-phenoxy]piperidine-1-carboxylate CAS Name: 4-[4-cyano-3-[2-[(4-iodophenyl)sulfonylamino]propoxy]-2-phenylphenoxy]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-cyano-3-[2-[(4-iodophenyl)sulfonylamino]propoxy]-2-phenylphenoxy]piperidine-1-carboxylate Traditional Name: 4-[4-cyano-3-[2-[(4-iodophenyl)sulfonylamino]propoxy]-2-phenyl-phenoxy]piperidine-1-carboxylic acid benzyl ester Formula: C35H34IN3O6S MolecularWeight: 751.63043

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(C=CC(=C1C2=CC=CC=C2)OC3CCN(CC3)C(=O)OCC4=CC=CC=C4)C#N)NS(=O)(=O)C5=CC=C(C=C5)I

Isomeric SMILES

CC(COC1=C(C=CC(=C1C2=CC=CC=C2)OC3CCN(CC3)C(=O)OCC4=CC=CC=C4)C#N)NS(=O)(=O)C5=CC=C(C=C5)I

InChI

InChI=1S/C35H34IN3O6S/c1-25(38-46(41,42)31-15-13-29(36)14-16-31)23-43-34-28(22-37)12-17-32(33(34)27-10-6-3-7-11-27)45-30-18-20-39(21-19-30)35(40)44-24-26-8-4-2-5-9-26/h2-17,25,30,38H,18-21,23-24H2,1H3