(E)-2-cyclohexyl-2-[[(E)-2-(4-iodophenyl)ethenyl]sulfonylamino]hept-5-enoic acid

Systemtic Name: (E)-2-cyclohexyl-2-[[(E)-2-(4-iodophenyl)ethenyl]sulfonylamino]hept-5-enoic acid Openeye Name: (E)-2-cyclohexyl-2-[[(E)-2-(4-iodophenyl)vinyl]sulfonylamino]hept-5-enoic acid CAS Name: (E)-2-cyclohexyl-2-[[(E)-2-(4-iodophenyl)ethenyl]sulfonylamino]-5-heptenoic acid IUPAC Name: (E)-2-cyclohexyl-2-[[(E)-2-(4-iodophenyl)ethenyl]sulfonylamino]hept-5-enoic acid Traditional Name: (E)-2-cyclohexyl-2-[[(E)-2-(4-iodophenyl)vinyl]sulfonylamino]hept-5-enoic acid Formula: C21H28INO4S MolecularWeight: 517.42079

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCC(C1CCCCC1)(C(=O)O)NS(=O)(=O)C=CC2=CC=C(C=C2)I

Isomeric SMILES

C/C=C/CCC(C1CCCCC1)(C(=O)O)NS(=O)(=O)/C=C/C2=CC=C(C=C2)I

InChI

InChI=1S/C21H28INO4S/c1-2-3-7-15-21(20(24)25,18-8-5-4-6-9-18)23-28(26,27)16-14-17-10-12-19(22)13-11-17/h2-3,10-14,16,18,23H,4-9,15H2,1H3,(H,24,25)/b3-2+,16-14+