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

Systemtic Name: 5-(1,3-diphenylbutyl)-3-ethyl-2-oxidanyl-benzenesulfonic acid Openeye Name: 5-(1,3-diphenylbutyl)-3-ethyl-2-hydroxy-benzenesulfonic acid CAS Name: 5-(1,3-diphenylbutyl)-3-ethyl-2-hydroxybenzenesulfonic acid IUPAC Name: 5-(1,3-diphenylbutyl)-3-ethyl-2-hydroxybenzenesulfonic acid Traditional Name: 5-(1,3-diphenylbutyl)-3-ethyl-2-hydroxy-besylic acid Formula: C24H26O4S MolecularWeight: 410.52584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)C(CC(C)C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)O)O

Isomeric SMILES

CCC1=C(C(=CC(=C1)C(CC(C)C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)O)O

InChI

InChI=1S/C24H26O4S/c1-3-18-15-21(16-23(24(18)25)29(26,27)28)22(20-12-8-5-9-13-20)14-17(2)19-10-6-4-7-11-19/h4-13,15-17,22,25H,3,14H2,1-2H3,(H,26,27,28)