dimethyl 5-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-(2-ketopyrrolidino)phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H20N2O7S MolecularWeight: 432.447

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)C(=O)OC

InChI

InChI=1S/C20H20N2O7S/c1-28-19(24)13-10-14(20(25)29-2)12-15(11-13)21-30(26,27)17-7-5-16(6-8-17)22-9-3-4-18(22)23/h5-8,10-12,21H,3-4,9H2,1-2H3