ethyl 8-[[(E)-2-(3-methylphenyl)ethenyl]sulfonylcarbamoylamino]octanoate

Systemtic Name: ethyl 8-[[(E)-2-(3-methylphenyl)ethenyl]sulfonylcarbamoylamino]octanoate Openeye Name: ethyl 8-[[(E)-2-(m-tolyl)vinyl]sulfonylcarbamoylamino]octanoate CAS Name: 8-[[[[(E)-2-(3-methylphenyl)ethenyl]sulfonylamino]-oxomethyl]amino]octanoic acid ethyl ester IUPAC Name: ethyl 8-[[(E)-2-(3-methylphenyl)ethenyl]sulfonylcarbamoylamino]octanoate Traditional Name: 8-[[(E)-2-(m-tolyl)vinyl]sulfonylcarbamoylamino]caprylic acid ethyl ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O5S/c1-3-27-19(23)12-7-5-4-6-8-14-21-20(24)22-28(25,26)15-13-18-11-9-10-17(2)16-18/h9-11,13,15-16H,3-8,12,14H2,1-2H3,(H2,21,22,24)/b15-13+