3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: 3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: 3-[(3-fluoro-4-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=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCC[NH+]3CCOCC3)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCC[NH+]3CCOCC3)F

InChI

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