2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-morpholinosulfonylphenyl)acetamide CAS Name: 2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-N-[4-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-morpholinosulfonylphenyl)acetamide Formula: C23H31N4O5S+ MolecularWeight: 475.58104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

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