[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 3-(2-phenylethenylsulfonylamino)benzoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 3-(2-phenylethenylsulfonylamino)benzoate Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl] 3-(styrylsulfonylamino)benzoate CAS Name: 3-(2-phenylethenylsulfonylamino)benzoic acid [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 3-(2-phenylethenylsulfonylamino)benzoate Traditional Name: 3-(styrylsulfonylamino)benzoic acid [2-keto-2-(piperonylamino)ethyl] ester Formula: C25H22N2O7S MolecularWeight: 494.51638

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)C3=CC(=CC=C3)NS(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)C3=CC(=CC=C3)NS(=O)(=O)C=CC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O7S/c28-24(26-15-19-9-10-22-23(13-19)34-17-33-22)16-32-25(29)20-7-4-8-21(14-20)27-35(30,31)12-11-18-5-2-1-3-6-18/h1-14,27H,15-17H2,(H,26,28)