2-morpholin-4-ium-4-yl-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide

Systemtic Name: 2-morpholin-4-ium-4-yl-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide Openeye Name: N-[2-isopropoxy-5-(1-piperidylsulfonyl)phenyl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: 2-(4-morpholin-4-iumyl)-N-[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyphenyl]acetamide IUPAC Name: 2-morpholin-4-ium-4-yl-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyphenyl)acetamide Traditional Name: N-(2-isopropoxy-5-piperidinosulfonyl-phenyl)-2-morpholin-4-ium-4-yl-acetamide Formula: C20H32N3O5S+ MolecularWeight: 426.55018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH+]3CCOCC3

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH+]3CCOCC3

InChI

InChI=1S/C20H31N3O5S/c1-16(2)28-19-7-6-17(29(25,26)23-8-4-3-5-9-23)14-18(19)21-20(24)15-22-10-12-27-13-11-22/h6-7,14,16H,3-5,8-13,15H2,1-2H3,(H,21,24)/p+1