4-butoxy-N'-(5-nitro-2-oxidanylidene-indol-1-ium-3-yl)benzenesulfonohydrazide

Systemtic Name: 4-butoxy-N'-(5-nitro-2-oxidanylidene-indol-1-ium-3-yl)benzenesulfonohydrazide Openeye Name: 4-butoxy-N'-(5-nitro-2-oxo-indol-1-ium-3-yl)benzenesulfonohydrazide CAS Name: 4-butoxy-N'-(5-nitro-2-oxo-3-indol-1-iumyl)benzenesulfonohydrazide IUPAC Name: 4-butoxy-N'-(5-nitro-2-oxoindol-1-ium-3-yl)benzenesulfonohydrazide Traditional Name: 4-butoxy-N'-(2-keto-5-nitro-indol-1-ium-3-yl)benzenesulfonohydrazide Formula: C18H19N4O6S+ MolecularWeight: 419.43166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NNC2=C3C=C(C=CC3=[NH+]C2=O)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NNC2=C3C=C(C=CC3=[NH+]C2=O)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O6S/c1-2-3-10-28-13-5-7-14(8-6-13)29(26,27)21-20-17-15-11-12(22(24)25)4-9-16(15)19-18(17)23/h4-9,11,21H,2-3,10H2,1H3,(H,19,20,23)/p+1