N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[4-chloro-3-(1-piperidylsulfonyl)phenyl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-(4-chloro-3-piperidinosulfonyl-phenyl)-2-morpholin-4-ium-4-yl-acetamide Formula: C17H25ClN3O4S+ MolecularWeight: 402.9161

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C[NH+]3CCOCC3)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C[NH+]3CCOCC3)Cl

InChI

InChI=1S/C17H24ClN3O4S/c18-15-5-4-14(19-17(22)13-20-8-10-25-11-9-20)12-16(15)26(23,24)21-6-2-1-3-7-21/h4-5,12H,1-3,6-11,13H2,(H,19,22)/p+1