dimethyl 5-[2-(4-pyrrolidin-1-ylsulfonylphenoxy)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(4-pyrrolidin-1-ylsulfonylphenoxy)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(4-pyrrolidin-1-ylsulfonylphenoxy)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-[4-(1-pyrrolidinylsulfonyl)phenoxy]ethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(4-pyrrolidin-1-ylsulfonylphenoxy)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(4-pyrrolidinosulfonylphenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H24N2O8S MolecularWeight: 476.49956

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)OC

InChI

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