N-(2-morpholin-4-ylphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-morpholin-4-ylphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-morpholinophenyl)acetamide CAS Name: N-[2-(4-morpholinyl)phenyl]-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-morpholin-4-ylphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-morpholinophenyl)-2-(4-p-cumenylsulfonylpiperazin-1-ium-1-yl)acetamide Formula: C25H35N4O4S+ MolecularWeight: 487.6348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3N4CCOCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3N4CCOCC4

InChI

InChI=1S/C25H34N4O4S/c1-20(2)21-7-9-22(10-8-21)34(31,32)29-13-11-27(12-14-29)19-25(30)26-23-5-3-4-6-24(23)28-15-17-33-18-16-28/h3-10,20H,11-19H2,1-2H3,(H,26,30)/p+1