[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(diethylsulfamoyl)phenyl]-2-propenoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(diethylsulfamoyl)phenyl]acrylic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)OCC(=O)NCC#C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)OCC(=O)NCC#C

InChI

InChI=1S/C18H22N2O5S/c1-4-13-19-17(21)14-25-18(22)12-9-15-7-10-16(11-8-15)26(23,24)20(5-2)6-3/h1,7-12H,5-6,13-14H2,2-3H3,(H,19,21)/b12-9+