2-[S-phenyl-N-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-sulfonimidoyl]ethanoic acid

Systemtic Name: 2-[S-phenyl-N-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-sulfonimidoyl]ethanoic acid Openeye Name: 2-[S-phenyl-N-(2,4,6-triisopropylphenyl)sulfonyl-sulfonimidoyl]acetic acid CAS Name: 2-[S-phenyl-N-[2,4,6-tri(propan-2-yl)phenyl]sulfonylsulfonimidoyl]acetic acid IUPAC Name: 2-[S-phenyl-N-[2,4,6-tri(propan-2-yl)phenyl]sulfonylsulfonimidoyl]acetic acid Traditional Name: 2-[S-phenyl-N-(2,4,6-triisopropylphenyl)sulfonyl-sulfonimidoyl]acetic acid Formula: C23H31NO5S2 MolecularWeight: 465.62594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N=S(=O)(CC(=O)O)C2=CC=CC=C2)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N=[S@](=O)(CC(=O)O)C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C23H31NO5S2/c1-15(2)18-12-20(16(3)4)23(21(13-18)17(5)6)31(28,29)24-30(27,14-22(25)26)19-10-8-7-9-11-19/h7-13,15-17H,14H2,1-6H3,(H,25,26)/t30-/m0/s1