3,5-dimethyl-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-1,2-oxazole-4-sulfonamide

Systemtic Name: 3,5-dimethyl-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-1,2-oxazole-4-sulfonamide Openeye Name: 3,5-dimethyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]isoxazole-4-sulfonamide CAS Name: 3,5-dimethyl-N-[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]-4-isoxazolesulfonamide IUPAC Name: 3,5-dimethyl-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]-1,2-oxazole-4-sulfonamide Traditional Name: 3,5-dimethyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]isoxazole-4-sulfonamide Formula: C18H26N3O4S+ MolecularWeight: 380.48174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NS(=O)(=O)C3=C(ON=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NS(=O)(=O)C3=C(ON=C3C)C

InChI

InChI=1S/C18H25N3O4S/c1-13-4-6-16(7-5-13)17(12-21-8-10-24-11-9-21)20-26(22,23)18-14(2)19-25-15(18)3/h4-7,17,20H,8-12H2,1-3H3/p+1/t17-/m0/s1