ethyl 3-[[4-(2,5-dimethoxy-4-methyl-phenyl)-4-oxidanylidene-butanoyl]-methylsulfonyl-amino]benzoate

Systemtic Name: ethyl 3-[[4-(2,5-dimethoxy-4-methyl-phenyl)-4-oxidanylidene-butanoyl]-methylsulfonyl-amino]benzoate Openeye Name: ethyl 3-[[4-(2,5-dimethoxy-4-methyl-phenyl)-4-oxo-butanoyl]-methylsulfonyl-amino]benzoate CAS Name: 3-[[4-(2,5-dimethoxy-4-methylphenyl)-1,4-dioxobutyl]-methylsulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(2,5-dimethoxy-4-methylphenyl)-4-oxobutanoyl]-methylsulfonylamino]benzoate Traditional Name: 3-[[4-(2,5-dimethoxy-4-methyl-phenyl)-4-keto-butanoyl]-mesyl-amino]benzoic acid ethyl ester Formula: C23H27NO8S MolecularWeight: 477.52738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N(C(=O)CCC(=O)C2=CC(=C(C=C2OC)C)OC)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N(C(=O)CCC(=O)C2=CC(=C(C=C2OC)C)OC)S(=O)(=O)C

InChI

InChI=1S/C23H27NO8S/c1-6-32-23(27)16-8-7-9-17(13-16)24(33(5,28)29)22(26)11-10-19(25)18-14-20(30-3)15(2)12-21(18)31-4/h7-9,12-14H,6,10-11H2,1-5H3