2-[ethyl-(4-methylphenyl)sulfonyl-amino]-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide

Systemtic Name: 2-[ethyl-(4-methylphenyl)sulfonyl-amino]-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: 2-[ethyl(p-tolylsulfonyl)amino]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: 2-[ethyl-(4-methylphenyl)sulfonylamino]-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-[ethyl-(4-methylphenyl)sulfonylamino]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-[ethyl(tosyl)amino]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C18H30N3O4S+ MolecularWeight: 384.5135

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCCC[NH+]1CCOCC1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC(=O)NCCC[NH+]1CCOCC1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H29N3O4S/c1-3-21(26(23,24)17-7-5-16(2)6-8-17)15-18(22)19-9-4-10-20-11-13-25-14-12-20/h5-8H,3-4,9-15H2,1-2H3,(H,19,22)/p+1