[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-[(4-chlorophenyl)-prop-2-enyl-sulfamoyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-[(4-chlorophenyl)-prop-2-enyl-sulfamoyl]benzoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 3-[allyl-(4-chlorophenyl)sulfamoyl]benzoate CAS Name: 3-[(4-chlorophenyl)-prop-2-enylsulfamoyl]benzoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 3-[(4-chlorophenyl)-prop-2-enylsulfamoyl]benzoate Traditional Name: 3-[allyl-(4-chlorophenyl)sulfamoyl]benzoic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C22H22ClN3O6S MolecularWeight: 491.94458

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)N(CC=C)C2=CC=C(C=C2)Cl

Isomeric SMILES

C=CCNC(=O)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)N(CC=C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H22ClN3O6S/c1-3-12-24-22(29)25-20(27)15-32-21(28)16-6-5-7-19(14-16)33(30,31)26(13-4-2)18-10-8-17(23)9-11-18/h3-11,14H,1-2,12-13,15H2,(H2,24,25,27,29)