ethyl 8-[[(E)-2-(4-propan-2-yloxyphenyl)ethenyl]sulfonylcarbamoylamino]octanoate

Systemtic Name: ethyl 8-[[(E)-2-(4-propan-2-yloxyphenyl)ethenyl]sulfonylcarbamoylamino]octanoate Openeye Name: ethyl 8-[[(E)-2-(4-isopropoxyphenyl)vinyl]sulfonylcarbamoylamino]octanoate CAS Name: 8-[[oxo-[[(E)-2-(4-propan-2-yloxyphenyl)ethenyl]sulfonylamino]methyl]amino]octanoic acid ethyl ester IUPAC Name: ethyl 8-[[(E)-2-(4-propan-2-yloxyphenyl)ethenyl]sulfonylcarbamoylamino]octanoate Traditional Name: 8-[[(E)-2-(4-isopropoxyphenyl)vinyl]sulfonylcarbamoylamino]caprylic acid ethyl ester Formula: C22H34N2O6S MolecularWeight: 454.58016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCCNC(=O)NS(=O)(=O)C=CC1=CC=C(C=C1)OC(C)C

Isomeric SMILES

CCOC(=O)CCCCCCCNC(=O)NS(=O)(=O)/C=C/C1=CC=C(C=C1)OC(C)C

InChI

InChI=1S/C22H34N2O6S/c1-4-29-21(25)10-8-6-5-7-9-16-23-22(26)24-31(27,28)17-15-19-11-13-20(14-12-19)30-18(2)3/h11-15,17-18H,4-10,16H2,1-3H3,(H2,23,24,26)/b17-15+