2-oxidanyl-3-(1-phenylethyl)-5-(phenylmethyl)benzenesulfonic acid

Systemtic Name: 2-oxidanyl-3-(1-phenylethyl)-5-(phenylmethyl)benzenesulfonic acid Openeye Name: 5-benzyl-2-hydroxy-3-(1-phenylethyl)benzenesulfonic acid CAS Name: 2-hydroxy-3-(1-phenylethyl)-5-(phenylmethyl)benzenesulfonic acid IUPAC Name: 5-benzyl-2-hydroxy-3-(1-phenylethyl)benzenesulfonic acid Traditional Name: 5-benzyl-2-hydroxy-3-(1-phenylethyl)besylic acid Formula: C21H20O4S MolecularWeight: 368.4461

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2=C(C(=CC(=C2)CC3=CC=CC=C3)S(=O)(=O)O)O

Isomeric SMILES

CC(C1=CC=CC=C1)C2=C(C(=CC(=C2)CC3=CC=CC=C3)S(=O)(=O)O)O

InChI

InChI=1S/C21H20O4S/c1-15(18-10-6-3-7-11-18)19-13-17(12-16-8-4-2-5-9-16)14-20(21(19)22)26(23,24)25/h2-11,13-15,22H,12H2,1H3,(H,23,24,25)