2-[(4-fluoranyl-2-methyl-phenyl)sulfonylamino]-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: 2-[(4-fluoranyl-2-methyl-phenyl)sulfonylamino]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: 2-[(4-fluoro-2-methyl-phenyl)sulfonylamino]-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: 2-[(4-fluoro-2-methylphenyl)sulfonylamino]-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 2-[(4-fluoro-2-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: 2-[(4-fluoro-2-methyl-phenyl)sulfonylamino]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C20H25FN3O4S+ MolecularWeight: 422.493603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)S(=O)(=O)NC2=CC=CC=C2C(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)F)S(=O)(=O)NC2=CC=CC=C2C(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C20H24FN3O4S/c1-15-14-16(21)6-7-19(15)29(26,27)23-18-5-3-2-4-17(18)20(25)22-8-9-24-10-12-28-13-11-24/h2-7,14,23H,8-13H2,1H3,(H,22,25)/p+1