8-[[(E)-2-phenylethenyl]sulfonylcarbamoylamino]octanoic acid

Systemtic Name: 8-[[(E)-2-phenylethenyl]sulfonylcarbamoylamino]octanoic acid Openeye Name: 8-[[(E)-styryl]sulfonylcarbamoylamino]octanoic acid CAS Name: 8-[[oxo-[[(E)-2-phenylethenyl]sulfonylamino]methyl]amino]octanoic acid IUPAC Name: 8-[[(E)-2-phenylethenyl]sulfonylcarbamoylamino]octanoic acid Traditional Name: 8-[[(E)-styryl]sulfonylcarbamoylamino]caprylic acid Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CS(=O)(=O)NC(=O)NCCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/S(=O)(=O)NC(=O)NCCCCCCCC(=O)O

InChI

InChI=1S/C17H24N2O5S/c20-16(21)11-7-2-1-3-8-13-18-17(22)19-25(23,24)14-12-15-9-5-4-6-10-15/h4-6,9-10,12,14H,1-3,7-8,11,13H2,(H,20,21)(H2,18,19,22)/b14-12+