2-[4-(2-morpholin-4-ylethylsulfamoyl)phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid

Systemtic Name: 2-[4-(2-morpholin-4-ylethylsulfamoyl)phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid Openeye Name: 2-[4-(2-morpholinoethylsulfamoyl)phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid CAS Name: 2-[4-[2-(4-morpholinyl)ethylsulfamoyl]phenyl]-4-[4-(1-pyrrolidinyl)phenyl]butanoic acid IUPAC Name: 2-[4-(2-morpholin-4-ylethylsulfamoyl)phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid Traditional Name: 2-[4-(2-morpholinoethylsulfamoyl)phenyl]-4-(4-pyrrolidinophenyl)butyric acid Formula: C26H35N3O5S MolecularWeight: 501.6382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)CCC(C3=CC=C(C=C3)S(=O)(=O)NCCN4CCOCC4)C(=O)O

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)CCC(C3=CC=C(C=C3)S(=O)(=O)NCCN4CCOCC4)C(=O)O

InChI

InChI=1S/C26H35N3O5S/c30-26(31)25(12-5-21-3-8-23(9-4-21)29-14-1-2-15-29)22-6-10-24(11-7-22)35(32,33)27-13-16-28-17-19-34-20-18-28/h3-4,6-11,25,27H,1-2,5,12-20H2,(H,30,31)