methyl 4,5-dimethoxy-2-[[1-(4-methylphenyl)sulfonyl-5-oxidanylidene-pyrrolidin-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[[1-(4-methylphenyl)sulfonyl-5-oxidanylidene-pyrrolidin-2-yl]carbonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[[5-oxo-1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[[1-(4-methylphenyl)sulfonyl-5-oxo-2-pyrrolidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[[1-(4-methylphenyl)sulfonyl-5-oxopyrrolidine-2-carbonyl]amino]benzoate Traditional Name: 2-[(5-keto-1-tosyl-prolyl)amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C22H24N2O8S MolecularWeight: 476.49956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2=O)C(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2=O)C(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC

InChI

InChI=1S/C22H24N2O8S/c1-13-5-7-14(8-6-13)33(28,29)24-17(9-10-20(24)25)21(26)23-16-12-19(31-3)18(30-2)11-15(16)22(27)32-4/h5-8,11-12,17H,9-10H2,1-4H3,(H,23,26)