8-[4-(diphenylmethyl)piperazin-4-ium-1-yl]sulfonylquinoline

Systemtic Name: 8-[4-(diphenylmethyl)piperazin-4-ium-1-yl]sulfonylquinoline Openeye Name: 8-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonylquinoline CAS Name: 8-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]sulfonyl]quinoline IUPAC Name: 8-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonylquinoline Traditional Name: 8-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonylquinoline Formula: C26H26N3O2S+ MolecularWeight: 444.56854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C26H25N3O2S/c30-32(31,24-15-7-13-21-14-8-16-27-25(21)24)29-19-17-28(18-20-29)26(22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-16,26H,17-20H2/p+1