N-[2-(4-methylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-2-phenoxy-ethanamide

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-2-phenoxy-ethanamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]-2-phenoxy-acetamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)-5-(4-morpholinylsulfonyl)phenyl]-2-phenoxyacetamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)-5-morpholin-4-ylsulfonylphenyl]-2-phenoxyacetamide Traditional Name: N-[2-(4-methylpiperazin-4-ium-1-yl)-5-morpholinosulfonyl-phenyl]-2-phenoxy-acetamide Formula: C23H31N4O5S+ MolecularWeight: 475.58104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C23H30N4O5S/c1-25-9-11-26(12-10-25)22-8-7-20(33(29,30)27-13-15-31-16-14-27)17-21(22)24-23(28)18-32-19-5-3-2-4-6-19/h2-8,17H,9-16,18H2,1H3,(H,24,28)/p+1