1-(4-methylsulfonylphenyl)sulfonyl-2-octyl-4-(triphenylmethyl)piperazine

Systemtic Name: 1-(4-methylsulfonylphenyl)sulfonyl-2-octyl-4-(triphenylmethyl)piperazine Openeye Name: 1-(4-methylsulfonylphenyl)sulfonyl-2-octyl-4-trityl-piperazine CAS Name: 1-(4-methylsulfonylphenyl)sulfonyl-2-octyl-4-(triphenylmethyl)piperazine IUPAC Name: 1-(4-methylsulfonylphenyl)sulfonyl-2-octyl-4-tritylpiperazine Traditional Name: 1-(4-mesylphenyl)sulfonyl-2-octyl-4-trityl-piperazine Formula: C38H46N2O4S2 MolecularWeight: 658.91284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H46N2O4S2/c1-3-4-5-6-7-17-24-35-31-39(29-30-40(35)46(43,44)37-27-25-36(26-28-37)45(2,41)42)38(32-18-11-8-12-19-32,33-20-13-9-14-21-33)34-22-15-10-16-23-34/h8-16,18-23,25-28,35H,3-7,17,24,29-31H2,1-2H3