(E)-oxidanyl-(4-oxidanylidenebutanoyl)-[(4-sulfophenyl)methylidene]azanium

Systemtic Name: (E)-oxidanyl-(4-oxidanylidenebutanoyl)-[(4-sulfophenyl)methylidene]azanium Openeye Name: (E)-hydroxy-(4-oxobutanoyl)-[(4-sulfophenyl)methylene]ammonium CAS Name: (E)-1,4-dioxobutyl-hydroxy-[(4-sulfophenyl)methylidene]ammonium IUPAC Name: (E)-hydroxy-(4-oxobutanoyl)-[(4-sulfophenyl)methylidene]azanium Traditional Name: (E)-hydroxy-(4-ketobutanoyl)-(4-sulfobenzylidene)ammonium Formula: C11H12NO6S+ MolecularWeight: 286.28108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=[N+](C(=O)CCC=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1/C=[N+](\C(=O)CCC=O)/O)S(=O)(=O)O

InChI

InChI=1S/C11H11NO6S/c13-7-1-2-11(14)12(15)8-9-3-5-10(6-4-9)19(16,17)18/h3-8H,1-2H2,(H-,15,16,17,18)/p+1/b12-8+