4-[[[(1R,2R)-2-[[4-(2-sulfamoylphenyl)phenyl]methylcarbamoyl]cyclopentyl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[(1R,2R)-2-[[4-(2-sulfamoylphenyl)phenyl]methylcarbamoyl]cyclopentyl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[[(1R,2R)-2-[[4-(2-sulfamoylphenyl)phenyl]methylcarbamoyl]cyclopentanecarbonyl]amino]methyl]benzoic acid CAS Name: 4-[[[oxo-[(1R,2R)-2-[oxo-[[4-(2-sulfamoylphenyl)phenyl]methylamino]methyl]cyclopentyl]methyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[(1R,2R)-2-[[4-(2-sulfamoylphenyl)phenyl]methylcarbamoyl]cyclopentanecarbonyl]amino]methyl]benzoic acid Traditional Name: 4-[[[(1R,2R)-2-[[4-(2-sulfamoylphenyl)benzyl]carbamoyl]cyclopentanecarbonyl]amino]methyl]benzoic acid Formula: C28H29N3O6S MolecularWeight: 535.61136

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)C(=O)NCC2=CC=C(C=C2)C(=O)O)C(=O)NCC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

Isomeric SMILES

C1C[C@H]([C@@H](C1)C(=O)NCC2=CC=C(C=C2)C(=O)O)C(=O)NCC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

InChI

InChI=1S/C28H29N3O6S/c29-38(36,37)25-7-2-1-4-22(25)20-12-8-18(9-13-20)16-30-26(32)23-5-3-6-24(23)27(33)31-17-19-10-14-21(15-11-19)28(34)35/h1-2,4,7-15,23-24H,3,5-6,16-17H2,(H,30,32)(H,31,33)(H,34,35)(H2,29,36,37)/t23-,24-/m1/s1