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

Systemtic Name: 2-(4-oxidanylpiperidin-1-ium-1-yl)-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide Openeye Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-[2-isopropoxy-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(4-hydroxy-1-piperidin-1-iumyl)-N-[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyphenyl]acetamide IUPAC Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyphenyl)acetamide Traditional Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-(2-isopropoxy-5-piperidinosulfonyl-phenyl)acetamide Formula: C21H34N3O5S+ MolecularWeight: 440.57676

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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+]3CCC(CC3)O

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH+]3CCC(CC3)O

InChI

InChI=1S/C21H33N3O5S/c1-16(2)29-20-7-6-18(30(27,28)24-10-4-3-5-11-24)14-19(20)22-21(26)15-23-12-8-17(25)9-13-23/h6-7,14,16-17,25H,3-5,8-13,15H2,1-2H3,(H,22,26)/p+1