2-[[4-[3-(3-bromophenyl)propanoylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[3-(3-bromophenyl)propanoylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[3-(3-bromophenyl)propanoylamino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[3-(3-bromophenyl)-1-oxopropyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[3-(3-bromophenyl)propanoylamino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[3-(3-bromophenyl)propanoylamino]phenyl]sulfonylamino]acetic acid Formula: C17H17BrN2O5S MolecularWeight: 441.29628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C17H17BrN2O5S/c18-13-3-1-2-12(10-13)4-9-16(21)20-14-5-7-15(8-6-14)26(24,25)19-11-17(22)23/h1-3,5-8,10,19H,4,9,11H2,(H,20,21)(H,22,23)