butyl 4-[[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]benzoate

Systemtic Name: butyl 4-[[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]benzoate Openeye Name: butyl 4-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzoate CAS Name: 4-[[3-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzoate Traditional Name: 4-[[4-(2-ketopyrrolidino)-3-methyl-phenyl]sulfonylamino]benzoic acid butyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3=O)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCC3=O)C

InChI

InChI=1S/C22H26N2O5S/c1-3-4-14-29-22(26)17-7-9-18(10-8-17)23-30(27,28)19-11-12-20(16(2)15-19)24-13-5-6-21(24)25/h7-12,15,23H,3-6,13-14H2,1-2H3