2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(4-methoxy-3-piperidinosulfonyl-phenyl)acetamide Formula: C24H33N4O5S+ MolecularWeight: 489.60762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3O)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3O)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H32N4O5S/c1-33-22-10-9-19(17-23(22)34(31,32)28-11-5-2-6-12-28)25-24(30)18-26-13-15-27(16-14-26)20-7-3-4-8-21(20)29/h3-4,7-10,17,29H,2,5-6,11-16,18H2,1H3,(H,25,30)/p+1