ethyl 3-chloranyl-4-[[4-methoxy-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]benzoate

Systemtic Name: ethyl 3-chloranyl-4-[[4-methoxy-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]benzoate Openeye Name: ethyl 3-chloro-4-[[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzoate CAS Name: 3-chloro-4-[[4-methoxy-3-(2-oxo-1-pyrrolidinyl)phenyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-chloro-4-[[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]benzoate Traditional Name: 3-chloro-4-[[3-(2-ketopyrrolidino)-4-methoxy-phenyl]sulfonylamino]benzoic acid ethyl ester Formula: C20H21ClN2O6S MolecularWeight: 452.90854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)N3CCCC3=O)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)N3CCCC3=O)Cl

InChI

InChI=1S/C20H21ClN2O6S/c1-3-29-20(25)13-6-8-16(15(21)11-13)22-30(26,27)14-7-9-18(28-2)17(12-14)23-10-4-5-19(23)24/h6-9,11-12,22H,3-5,10H2,1-2H3