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

Systemtic Name: N-(2-ethoxy-5-morpholin-4-ylsulfonyl-phenyl)-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(2-ethoxy-5-morpholinosulfonyl-phenyl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[2-ethoxy-5-(4-morpholinylsulfonyl)phenyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(2-ethoxy-5-morpholinosulfonyl-phenyl)-2-piperidin-1-ium-1-yl-acetamide Formula: C19H30N3O5S+ MolecularWeight: 412.5236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCCCC3

InChI

InChI=1S/C19H29N3O5S/c1-2-27-18-7-6-16(28(24,25)22-10-12-26-13-11-22)14-17(18)20-19(23)15-21-8-4-3-5-9-21/h6-7,14H,2-5,8-13,15H2,1H3,(H,20,23)/p+1