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

Systemtic Name: N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-piperidin-1-ium-1-yl-acetamide Formula: C18H28N3O4S+ MolecularWeight: 382.49762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCCCC3

InChI

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