[1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate

Systemtic Name: [1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-1-methyl-2-oxo-ethyl] 3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate CAS Name: 3-[4-(diethylsulfamoyl)phenyl]-2-propenoic acid [1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl] 3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate Traditional Name: 3-[4-(diethylsulfamoyl)phenyl]acrylic acid [2-keto-1-methyl-2-(piperonylamino)ethyl] ester Formula: C24H28N2O7S MolecularWeight: 488.55332

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)OC(C)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)OC(C)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C24H28N2O7S/c1-4-26(5-2)34(29,30)20-10-6-18(7-11-20)9-13-23(27)33-17(3)24(28)25-15-19-8-12-21-22(14-19)32-16-31-21/h6-14,17H,4-5,15-16H2,1-3H3,(H,25,28)