4-[4-[4-(1-adamantyl)piperazin-4-ium-1-yl]sulfonylphenyl]sulfonylmorpholine

Systemtic Name: 4-[4-[4-(1-adamantyl)piperazin-4-ium-1-yl]sulfonylphenyl]sulfonylmorpholine Openeye Name: 4-[4-[4-(1-adamantyl)piperazin-4-ium-1-yl]sulfonylphenyl]sulfonylmorpholine CAS Name: 4-[4-[[4-(1-adamantyl)-1-piperazin-4-iumyl]sulfonyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[4-[4-(1-adamantyl)piperazin-4-ium-1-yl]sulfonylphenyl]sulfonylmorpholine Traditional Name: 4-[4-[4-(1-adamantyl)piperazin-4-ium-1-yl]sulfonylphenyl]sulfonylmorpholine Formula: C24H36N3O5S2+ MolecularWeight: 510.68974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=C(C=C5)S(=O)(=O)N6CCOCC6

Isomeric SMILES

C1CN(CC[NH+]1C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=C(C=C5)S(=O)(=O)N6CCOCC6

InChI

InChI=1S/C24H35N3O5S2/c28-33(29,22-1-3-23(4-2-22)34(30,31)27-9-11-32-12-10-27)26-7-5-25(6-8-26)24-16-19-13-20(17-24)15-21(14-19)18-24/h1-4,19-21H,5-18H2/p+1