2-oxidanyl-5-[4-[2-[[(2R)-2-oxidanyl-2-phenyl-ethyl]amino]ethyl]phenyl]sulfonyl-benzoic acid

Systemtic Name: 2-oxidanyl-5-[4-[2-[[(2R)-2-oxidanyl-2-phenyl-ethyl]amino]ethyl]phenyl]sulfonyl-benzoic acid Openeye Name: 2-hydroxy-5-[4-[2-[[(2R)-2-hydroxy-2-phenyl-ethyl]amino]ethyl]phenyl]sulfonyl-benzoic acid CAS Name: 2-hydroxy-5-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]amino]ethyl]phenyl]sulfonylbenzoic acid IUPAC Name: 2-hydroxy-5-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]amino]ethyl]phenyl]sulfonylbenzoic acid Traditional Name: 2-hydroxy-5-[4-[2-[[(2R)-2-hydroxy-2-phenyl-ethyl]amino]ethyl]phenyl]sulfonyl-benzoic acid Formula: C23H23NO6S MolecularWeight: 441.49682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNCCC2=CC=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CNCCC2=CC=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)O)C(=O)O)O

InChI

InChI=1S/C23H23NO6S/c25-21-11-10-19(14-20(21)23(27)28)31(29,30)18-8-6-16(7-9-18)12-13-24-15-22(26)17-4-2-1-3-5-17/h1-11,14,22,24-26H,12-13,15H2,(H,27,28)/t22-/m0/s1