[1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate

Systemtic Name: [1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate Openeye Name: [1-methyl-2-(2-methylanilino)-2-oxo-ethyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid [1-(2-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylanilino)-1-oxopropan-2-yl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid [2-keto-1-methyl-2-(o-toluidino)ethyl] ester Formula: C25H24N2O7S MolecularWeight: 496.53226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C25H24N2O7S/c1-16-7-3-5-9-20(16)26-24(28)17(2)34-25(29)19-8-4-6-10-21(19)27-35(30,31)18-11-12-22-23(15-18)33-14-13-32-22/h3-12,15,17,27H,13-14H2,1-2H3,(H,26,28)