4-[(E)-C-butyl-N-oxidanyl-carbonimidoyl]benzene-1,3-disulfonic acid

Systemtic Name: 4-[(E)-C-butyl-N-oxidanyl-carbonimidoyl]benzene-1,3-disulfonic acid Openeye Name: 4-[(E)-C-butyl-N-hydroxy-carbonimidoyl]benzene-1,3-disulfonic acid CAS Name: 4-[(1E)-1-hydroxyiminopentyl]benzene-1,3-disulfonic acid IUPAC Name: 4-[(E)-C-butyl-N-hydroxycarbonimidoyl]benzene-1,3-disulfonic acid Traditional Name: 4-pentanehydroximoylbenzene-1,3-disulfonic acid Formula: C11H15NO7S2 MolecularWeight: 337.3693

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NO)C1=C(C=C(C=C1)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCC/C(=N\O)/C1=C(C=C(C=C1)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C11H15NO7S2/c1-2-3-4-10(12-13)9-6-5-8(20(14,15)16)7-11(9)21(17,18)19/h5-7,13H,2-4H2,1H3,(H,14,15,16)(H,17,18,19)/b12-10+