3-(1,3-diphenylbutyl)-2-oxidanyl-5-(1-phenylethyl)benzenesulfonic acid

Systemtic Name: 3-(1,3-diphenylbutyl)-2-oxidanyl-5-(1-phenylethyl)benzenesulfonic acid Openeye Name: 3-(1,3-diphenylbutyl)-2-hydroxy-5-(1-phenylethyl)benzenesulfonic acid CAS Name: 3-(1,3-diphenylbutyl)-2-hydroxy-5-(1-phenylethyl)benzenesulfonic acid IUPAC Name: 3-(1,3-diphenylbutyl)-2-hydroxy-5-(1-phenylethyl)benzenesulfonic acid Traditional Name: 3-(1,3-diphenylbutyl)-2-hydroxy-5-(1-phenylethyl)besylic acid Formula: C30H30O4S MolecularWeight: 486.6218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H30O4S/c1-21(23-12-6-3-7-13-23)18-27(25-16-10-5-11-17-25)28-19-26(20-29(30(28)31)35(32,33)34)22(2)24-14-8-4-9-15-24/h3-17,19-22,27,31H,18H2,1-2H3,(H,32,33,34)