ethyl 8-[[(Z)-1-(3-chlorophenyl)prop-1-en-2-yl]sulfonylcarbamoylamino]octanoate

Systemtic Name: ethyl 8-[[(Z)-1-(3-chlorophenyl)prop-1-en-2-yl]sulfonylcarbamoylamino]octanoate Openeye Name: ethyl 8-[[(Z)-2-(3-chlorophenyl)-1-methyl-vinyl]sulfonylcarbamoylamino]octanoate CAS Name: 8-[[[[(Z)-1-(3-chlorophenyl)prop-1-en-2-yl]sulfonylamino]-oxomethyl]amino]octanoic acid ethyl ester IUPAC Name: ethyl 8-[[(Z)-1-(3-chlorophenyl)prop-1-en-2-yl]sulfonylcarbamoylamino]octanoate Traditional Name: 8-[[(Z)-2-(3-chlorophenyl)-1-methyl-vinyl]sulfonylcarbamoylamino]caprylic acid ethyl ester Formula: C20H29ClN2O5S MolecularWeight: 444.97266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29ClN2O5S/c1-3-28-19(24)12-7-5-4-6-8-13-22-20(25)23-29(26,27)16(2)14-17-10-9-11-18(21)15-17/h9-11,14-15H,3-8,12-13H2,1-2H3,(H2,22,23,25)/b16-14-