N-(3-ethyl-2-methyl-1,3-benzoxazol-3-ium-5-yl)hexane-1-sulfonamide

Systemtic Name: N-(3-ethyl-2-methyl-1,3-benzoxazol-3-ium-5-yl)hexane-1-sulfonamide Openeye Name: N-(3-ethyl-2-methyl-1,3-benzoxazol-3-ium-5-yl)hexane-1-sulfonamide CAS Name: N-(3-ethyl-2-methyl-1,3-benzoxazol-3-ium-5-yl)-1-hexanesulfonamide IUPAC Name: N-(3-ethyl-2-methyl-1,3-benzoxazol-3-ium-5-yl)hexane-1-sulfonamide Traditional Name: N-(3-ethyl-2-methyl-1,3-benzoxazol-3-ium-5-yl)hexane-1-sulfonamide Formula: C16H25N2O3S+ MolecularWeight: 325.4463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)NC1=CC2=C(C=C1)OC(=[N+]2CC)C

Isomeric SMILES

CCCCCCS(=O)(=O)NC1=CC2=C(C=C1)OC(=[N+]2CC)C

InChI

InChI=1S/C16H25N2O3S/c1-4-6-7-8-11-22(19,20)17-14-9-10-16-15(12-14)18(5-2)13(3)21-16/h9-10,12,17H,4-8,11H2,1-3H3/q+1