2-[(3-ethanoylphenyl)-methylsulfonyl-amino]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide

Systemtic Name: 2-[(3-ethanoylphenyl)-methylsulfonyl-amino]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide Openeye Name: 2-(3-acetyl-N-methylsulfonyl-anilino)-N-(2-morpholin-4-ium-4-ylethyl)acetamide CAS Name: 2-(3-acetyl-N-methylsulfonylanilino)-N-[2-(4-morpholin-4-iumyl)ethyl]acetamide IUPAC Name: 2-(3-acetyl-N-methylsulfonylanilino)-N-(2-morpholin-4-ium-4-ylethyl)acetamide Traditional Name: 2-(3-acetyl-N-mesyl-anilino)-N-(2-morpholin-4-ium-4-ylethyl)acetamide Formula: C17H26N3O5S+ MolecularWeight: 384.47044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N(CC(=O)NCC[NH+]2CCOCC2)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N(CC(=O)NCC[NH+]2CCOCC2)S(=O)(=O)C

InChI

InChI=1S/C17H25N3O5S/c1-14(21)15-4-3-5-16(12-15)20(26(2,23)24)13-17(22)18-6-7-19-8-10-25-11-9-19/h3-5,12H,6-11,13H2,1-2H3,(H,18,22)/p+1