3-methyl-N-[(2R)-1-morpholin-4-ium-4-ylbutan-2-yl]-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: 3-methyl-N-[(2R)-1-morpholin-4-ium-4-ylbutan-2-yl]-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: 3-methyl-N-[(1R)-1-(morpholin-4-ium-4-ylmethyl)propyl]-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: 3-methyl-N-[(2R)-1-(4-morpholin-4-iumyl)butan-2-yl]-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: 3-methyl-N-[(2R)-1-morpholin-4-ium-4-ylbutan-2-yl]-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: 2-keto-3-methyl-N-[(1R)-1-(morpholin-4-ium-4-ylmethyl)propyl]-1,3-benzoxazole-6-sulfonamide Formula: C16H24N3O5S+ MolecularWeight: 370.44386

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C[NH+]1CCOCC1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)C

Isomeric SMILES

CC[C@H](C[NH+]1CCOCC1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)C

InChI

InChI=1S/C16H23N3O5S/c1-3-12(11-19-6-8-23-9-7-19)17-25(21,22)13-4-5-14-15(10-13)24-16(20)18(14)2/h4-5,10,12,17H,3,6-9,11H2,1-2H3/p+1/t12-/m1/s1