[2-[[5-(dimethylsulfamoyl)-2-methoxy-phenyl]amino]-2-oxidanylidene-ethyl] (3R)-3-acetamido-3-phenyl-propanoate

Systemtic Name: [2-[[5-(dimethylsulfamoyl)-2-methoxy-phenyl]amino]-2-oxidanylidene-ethyl] (3R)-3-acetamido-3-phenyl-propanoate Openeye Name: [2-[5-(dimethylsulfamoyl)-2-methoxy-anilino]-2-oxo-ethyl] (3R)-3-acetamido-3-phenyl-propanoate CAS Name: (3R)-3-acetamido-3-phenylpropanoic acid [2-[5-(dimethylsulfamoyl)-2-methoxyanilino]-2-oxoethyl] ester IUPAC Name: [2-[5-(dimethylsulfamoyl)-2-methoxyanilino]-2-oxoethyl] (3R)-3-acetamido-3-phenylpropanoate Traditional Name: (3R)-3-acetamido-3-phenyl-propionic acid [2-[5-(dimethylsulfamoyl)-2-methoxy-anilino]-2-keto-ethyl] ester Formula: C22H27N3O7S MolecularWeight: 477.53068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)OCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N(C)C)OC)C2=CC=CC=C2

Isomeric SMILES

CC(=O)N[C@H](CC(=O)OCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N(C)C)OC)C2=CC=CC=C2

InChI

InChI=1S/C22H27N3O7S/c1-15(26)23-18(16-8-6-5-7-9-16)13-22(28)32-14-21(27)24-19-12-17(10-11-20(19)31-4)33(29,30)25(2)3/h5-12,18H,13-14H2,1-4H3,(H,23,26)(H,24,27)/t18-/m1/s1