ethyl 3-[(4-methoxy-3-pyrrolidin-1-ylcarbonyl-phenyl)sulfonylamino]benzoate

Systemtic Name: ethyl 3-[(4-methoxy-3-pyrrolidin-1-ylcarbonyl-phenyl)sulfonylamino]benzoate Openeye Name: ethyl 3-[[4-methoxy-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]benzoate CAS Name: 3-[[4-methoxy-3-[oxo(1-pyrrolidinyl)methyl]phenyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-methoxy-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]benzoate Traditional Name: 3-[[4-methoxy-3-(pyrrolidine-1-carbonyl)phenyl]sulfonylamino]benzoic acid ethyl ester Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O6S/c1-3-29-21(25)15-7-6-8-16(13-15)22-30(26,27)17-9-10-19(28-2)18(14-17)20(24)23-11-4-5-12-23/h6-10,13-14,22H,3-5,11-12H2,1-2H3