(2R)-2-[1-oxidanyl-4-(quinolin-8-ylsulfonylamino)naphthalen-2-yl]sulfanylpropanoic acid

Systemtic Name: (2R)-2-[1-oxidanyl-4-(quinolin-8-ylsulfonylamino)naphthalen-2-yl]sulfanylpropanoic acid Openeye Name: (2R)-2-[[1-hydroxy-4-(8-quinolylsulfonylamino)-2-naphthyl]sulfanyl]propanoic acid CAS Name: (2R)-2-[[1-hydroxy-4-(8-quinolinylsulfonylamino)-2-naphthalenyl]thio]propanoic acid IUPAC Name: (2R)-2-[1-hydroxy-4-(quinolin-8-ylsulfonylamino)naphthalen-2-yl]sulfanylpropanoic acid Traditional Name: (2R)-2-[[1-hydroxy-4-(8-quinolylsulfonylamino)-2-naphthyl]thio]propionic acid Formula: C22H18N2O5S2 MolecularWeight: 454.51872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4)O

Isomeric SMILES

C[C@H](C(=O)O)SC1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4)O

InChI

InChI=1S/C22H18N2O5S2/c1-13(22(26)27)30-18-12-17(15-8-2-3-9-16(15)21(18)25)24-31(28,29)19-10-4-6-14-7-5-11-23-20(14)19/h2-13,24-25H,1H3,(H,26,27)/t13-/m1/s1