(4-oxidanyl-1,2-diphenyl-butyl) 4-methylbenzenesulfonate

Systemtic Name: (4-oxidanyl-1,2-diphenyl-butyl) 4-methylbenzenesulfonate Openeye Name: (4-hydroxy-1,2-diphenyl-butyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-hydroxy-1,2-diphenylbutyl) ester IUPAC Name: (4-hydroxy-1,2-diphenylbutyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-hydroxy-1,2-diphenyl-butyl) ester Formula: C23H24O4S MolecularWeight: 396.49926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24O4S/c1-18-12-14-21(15-13-18)28(25,26)27-23(20-10-6-3-7-11-20)22(16-17-24)19-8-4-2-5-9-19/h2-15,22-24H,16-17H2,1H3