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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)NC(=O)NS(=O)(=O)C=CC1=CC=CC=C1

Isomeric SMILES

CCCCCCC(C(=O)O)NC(=O)NS(=O)(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C17H24N2O5S/c1-2-3-4-8-11-15(16(20)21)18-17(22)19-25(23,24)13-12-14-9-6-5-7-10-14/h5-7,9-10,12-13,15H,2-4,8,11H2,1H3,(H,20,21)(H2,18,19,22)/b13-12+