2-heptadecyl-1-(4-methylphenyl)sulfonyl-4-(triphenylmethyl)piperazine

Systemtic Name: 2-heptadecyl-1-(4-methylphenyl)sulfonyl-4-(triphenylmethyl)piperazine Openeye Name: 2-heptadecyl-1-(p-tolylsulfonyl)-4-trityl-piperazine CAS Name: 2-heptadecyl-1-(4-methylphenyl)sulfonyl-4-(triphenylmethyl)piperazine IUPAC Name: 2-heptadecyl-1-(4-methylphenyl)sulfonyl-4-tritylpiperazine Traditional Name: 2-heptadecyl-1-tosyl-4-trityl-piperazine Formula: C47H64N2O2S MolecularWeight: 721.08826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C47H64N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-26-33-45-40-48(38-39-49(45)52(50,51)46-36-34-41(2)35-37-46)47(42-27-20-17-21-28-42,43-29-22-18-23-30-43)44-31-24-19-25-32-44/h17-25,27-32,34-37,45H,3-16,26,33,38-40H2,1-2H3