3-(1,3-diphenylbutyl)-4-methyl-2-oxidanyl-benzenesulfonic acid

Systemtic Name: 3-(1,3-diphenylbutyl)-4-methyl-2-oxidanyl-benzenesulfonic acid Openeye Name: 3-(1,3-diphenylbutyl)-2-hydroxy-4-methyl-benzenesulfonic acid CAS Name: 3-(1,3-diphenylbutyl)-2-hydroxy-4-methylbenzenesulfonic acid IUPAC Name: 3-(1,3-diphenylbutyl)-2-hydroxy-4-methylbenzenesulfonic acid Traditional Name: 3-(1,3-diphenylbutyl)-2-hydroxy-4-methyl-besylic acid Formula: C23H24O4S MolecularWeight: 396.49926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)O)O)C(CC(C)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)O)O)C(CC(C)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H24O4S/c1-16-13-14-21(28(25,26)27)23(24)22(16)20(19-11-7-4-8-12-19)15-17(2)18-9-5-3-6-10-18/h3-14,17,20,24H,15H2,1-2H3,(H,25,26,27)