methyl 4,5-dimethoxy-2-[(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylamino]benzoate CAS Name: 4,5-dimethoxy-2-[[4-(1-pyrrolidinylsulfonyl)phenyl]sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylamino]benzoate Traditional Name: 4,5-dimethoxy-2-[(4-pyrrolidinosulfonylphenyl)sulfonylamino]benzoic acid methyl ester Formula: C20H24N2O8S2 MolecularWeight: 484.54316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)OC

InChI

InChI=1S/C20H24N2O8S2/c1-28-18-12-16(20(23)30-3)17(13-19(18)29-2)21-31(24,25)14-6-8-15(9-7-14)32(26,27)22-10-4-5-11-22/h6-9,12-13,21H,4-5,10-11H2,1-3H3