N-hexyl-1-(2-sulfofuran-3-yl)methanimine oxide

Systemtic Name: N-hexyl-1-(2-sulfofuran-3-yl)methanimine oxide Openeye Name: N-hexyl-1-(2-sulfo-3-furyl)methanimine oxide CAS Name: N-hexyl-1-(2-sulfo-3-furanyl)methanimine oxide IUPAC Name: N-hexyl-1-(2-sulfofuran-3-yl)methanimine oxide Traditional Name: N-hexyl-1-(2-sulfo-3-furyl)methanimine oxide Formula: C11H17NO5S MolecularWeight: 275.32138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+](=CC1=C(OC=C1)S(=O)(=O)O)[O-]

Isomeric SMILES

CCCCCC/[N+](=C\C1=C(OC=C1)S(=O)(=O)O)/[O-]

InChI

InChI=1S/C11H17NO5S/c1-2-3-4-5-7-12(13)9-10-6-8-17-11(10)18(14,15)16/h6,8-9H,2-5,7H2,1H3,(H,14,15,16)/b12-9+