2-[4-(2-morpholin-4-ylethylsulfamoyl)phenyl]-4-(4-nitrophenyl)butanoic acid

Systemtic Name: 2-[4-(2-morpholin-4-ylethylsulfamoyl)phenyl]-4-(4-nitrophenyl)butanoic acid Openeye Name: 2-[4-(2-morpholinoethylsulfamoyl)phenyl]-4-(4-nitrophenyl)butanoic acid CAS Name: 2-[4-[2-(4-morpholinyl)ethylsulfamoyl]phenyl]-4-(4-nitrophenyl)butanoic acid IUPAC Name: 2-[4-(2-morpholin-4-ylethylsulfamoyl)phenyl]-4-(4-nitrophenyl)butanoic acid Traditional Name: 2-[4-(2-morpholinoethylsulfamoyl)phenyl]-4-(4-nitrophenyl)butyric acid Formula: C22H27N3O7S MolecularWeight: 477.53068

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNS(=O)(=O)C2=CC=C(C=C2)C(CCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1COCCN1CCNS(=O)(=O)C2=CC=C(C=C2)C(CCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C22H27N3O7S/c26-22(27)21(10-3-17-1-6-19(7-2-17)25(28)29)18-4-8-20(9-5-18)33(30,31)23-11-12-24-13-15-32-16-14-24/h1-2,4-9,21,23H,3,10-16H2,(H,26,27)