N-butyl-1-(2,4-disulfophenyl)methanimine oxide

Systemtic Name: N-butyl-1-(2,4-disulfophenyl)methanimine oxide Openeye Name: N-butyl-1-(2,4-disulfophenyl)methanimine oxide CAS Name: N-butyl-1-(2,4-disulfophenyl)methanimine oxide IUPAC Name: N-butyl-1-(2,4-disulfophenyl)methanimine oxide Traditional Name: N-butyl-1-(2,4-disulfophenyl)methanimine oxide Formula: C11H15NO7S2 MolecularWeight: 337.3693

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO7S2/c1-2-3-6-12(13)8-9-4-5-10(20(14,15)16)7-11(9)21(17,18)19/h4-5,7-8H,2-3,6H2,1H3,(H,14,15,16)(H,17,18,19)/b12-8+