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

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-(4-methyl-3-piperidinosulfonyl-phenyl)-2-morpholin-4-ium-4-yl-acetamide Formula: C18H28N3O4S+ MolecularWeight: 382.49762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCOCC2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCOCC2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H27N3O4S/c1-15-5-6-16(19-18(22)14-20-9-11-25-12-10-20)13-17(15)26(23,24)21-7-3-2-4-8-21/h5-6,13H,2-4,7-12,14H2,1H3,(H,19,22)/p+1