(4-formamido-3,3-diphenyl-butyl) 4-methylbenzenesulfonate

Systemtic Name: (4-formamido-3,3-diphenyl-butyl) 4-methylbenzenesulfonate Openeye Name: (4-formamido-3,3-diphenyl-butyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-formamido-3,3-diphenylbutyl) ester IUPAC Name: (4-formamido-3,3-diphenylbutyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-formamido-3,3-diphenyl-butyl) ester Formula: C24H25NO4S MolecularWeight: 423.5246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25NO4S/c1-20-12-14-23(15-13-20)30(27,28)29-17-16-24(18-25-19-26,21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-15,19H,16-18H2,1H3,(H,25,26)