2-[4-[(2-azanyl-2-oxidanylidene-ethyl)sulfamoyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid

Systemtic Name: 2-[4-[(2-azanyl-2-oxidanylidene-ethyl)sulfamoyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid Openeye Name: 2-[4-[(2-amino-2-oxo-ethyl)sulfamoyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid CAS Name: 2-[4-[(2-amino-2-oxoethyl)sulfamoyl]phenyl]-4-[4-(1-pyrrolidinyl)phenyl]butanoic acid IUPAC Name: 2-[4-[(2-amino-2-oxoethyl)sulfamoyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid Traditional Name: 2-[4-[(2-amino-2-keto-ethyl)sulfamoyl]phenyl]-4-(4-pyrrolidinophenyl)butyric acid Formula: C22H27N3O5S MolecularWeight: 445.53188

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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)NCC(=O)N)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O5S/c23-21(26)15-24-31(29,30)19-10-6-17(7-11-19)20(22(27)28)12-5-16-3-8-18(9-4-16)25-13-1-2-14-25/h3-4,6-11,20,24H,1-2,5,12-15H2,(H2,23,26)(H,27,28)