5-oxidanyl-2-[2-[4-oxidanyl-2-(1-phenylethyl)phenyl]propan-2-yl]-3-(1-phenylethyl)benzenesulfonic acid

Systemtic Name: 5-oxidanyl-2-[2-[4-oxidanyl-2-(1-phenylethyl)phenyl]propan-2-yl]-3-(1-phenylethyl)benzenesulfonic acid Openeye Name: 5-hydroxy-2-[1-[4-hydroxy-2-(1-phenylethyl)phenyl]-1-methyl-ethyl]-3-(1-phenylethyl)benzenesulfonic acid CAS Name: 5-hydroxy-2-[2-[4-hydroxy-2-(1-phenylethyl)phenyl]propan-2-yl]-3-(1-phenylethyl)benzenesulfonic acid IUPAC Name: 5-hydroxy-2-[2-[4-hydroxy-2-(1-phenylethyl)phenyl]propan-2-yl]-3-(1-phenylethyl)benzenesulfonic acid Traditional Name: 5-hydroxy-2-[1-[4-hydroxy-2-(1-phenylethyl)phenyl]-1-methyl-ethyl]-3-(1-phenylethyl)besylic acid Formula: C31H32O5S MolecularWeight: 516.64778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2=CC(=CC(=C2C(C)(C)C3=C(C=C(C=C3)O)C(C)C4=CC=CC=C4)S(=O)(=O)O)O

Isomeric SMILES

CC(C1=CC=CC=C1)C2=CC(=CC(=C2C(C)(C)C3=C(C=C(C=C3)O)C(C)C4=CC=CC=C4)S(=O)(=O)O)O

InChI

InChI=1S/C31H32O5S/c1-20(22-11-7-5-8-12-22)26-17-24(32)15-16-28(26)31(3,4)30-27(21(2)23-13-9-6-10-14-23)18-25(33)19-29(30)37(34,35)36/h5-21,32-33H,1-4H3,(H,34,35,36)