N-[2-(5-chloranyl-2-methyl-1,3-benzoxazol-3-ium-3-yl)ethyl]methanesulfonamide

Systemtic Name: N-[2-(5-chloranyl-2-methyl-1,3-benzoxazol-3-ium-3-yl)ethyl]methanesulfonamide Openeye Name: N-[2-(5-chloro-2-methyl-1,3-benzoxazol-3-ium-3-yl)ethyl]methanesulfonamide CAS Name: N-[2-(5-chloro-2-methyl-1,3-benzoxazol-3-ium-3-yl)ethyl]methanesulfonamide IUPAC Name: N-[2-(5-chloro-2-methyl-1,3-benzoxazol-3-ium-3-yl)ethyl]methanesulfonamide Traditional Name: N-[2-(5-chloro-2-methyl-1,3-benzoxazol-3-ium-3-yl)ethyl]methanesulfonamide Formula: C11H14ClN2O3S+ MolecularWeight: 289.75846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(O1)C=CC(=C2)Cl)CCNS(=O)(=O)C

Isomeric SMILES

CC1=[N+](C2=C(O1)C=CC(=C2)Cl)CCNS(=O)(=O)C

InChI

InChI=1S/C11H14ClN2O3S/c1-8-14(6-5-13-18(2,15)16)10-7-9(12)3-4-11(10)17-8/h3-4,7,13H,5-6H2,1-2H3/q+1