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

Systemtic Name: N-(phenylmethyl)-1-(2-sulfofuran-3-yl)methanimine oxide Openeye Name: N-benzyl-1-(2-sulfo-3-furyl)methanimine oxide CAS Name: N-(phenylmethyl)-1-(2-sulfo-3-furanyl)methanimine oxide IUPAC Name: N-benzyl-1-(2-sulfofuran-3-yl)methanimine oxide Traditional Name: N-benzyl-1-(2-sulfo-3-furyl)methanimine oxide Formula: C12H11NO5S MolecularWeight: 281.28444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+](=CC2=C(OC=C2)S(=O)(=O)O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C/[N+](=C/C2=C(OC=C2)S(=O)(=O)O)/[O-]

InChI

InChI=1S/C12H11NO5S/c14-13(8-10-4-2-1-3-5-10)9-11-6-7-18-12(11)19(15,16)17/h1-7,9H,8H2,(H,15,16,17)/b13-9-