2-octyl-1-(3,4,5-trimethoxyphenyl)sulfonyl-4-(triphenylmethyl)piperazine

Systemtic Name: 2-octyl-1-(3,4,5-trimethoxyphenyl)sulfonyl-4-(triphenylmethyl)piperazine Openeye Name: 2-octyl-1-(3,4,5-trimethoxyphenyl)sulfonyl-4-trityl-piperazine CAS Name: 2-octyl-1-(3,4,5-trimethoxyphenyl)sulfonyl-4-(triphenylmethyl)piperazine IUPAC Name: 2-octyl-1-(3,4,5-trimethoxyphenyl)sulfonyl-4-tritylpiperazine Traditional Name: 2-octyl-1-(3,4,5-trimethoxyphenyl)sulfonyl-4-trityl-piperazine Formula: C40H50N2O5S MolecularWeight: 670.9004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CN(CCN1S(=O)(=O)C2=CC(=C(C(=C2)OC)OC)OC)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCCCCCC1CN(CCN1S(=O)(=O)C2=CC(=C(C(=C2)OC)OC)OC)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C40H50N2O5S/c1-5-6-7-8-9-19-26-35-31-41(27-28-42(35)48(43,44)36-29-37(45-2)39(47-4)38(30-36)46-3)40(32-20-13-10-14-21-32,33-22-15-11-16-23-33)34-24-17-12-18-25-34/h10-18,20-25,29-30,35H,5-9,19,26-28,31H2,1-4H3