[azaniumyl(azanyl)methylidene]-[3-[(2-methoxyphenyl)amino]-2-oxidanyl-propyl]azanium sulfate

Systemtic Name: [azaniumyl(azanyl)methylidene]-[3-[(2-methoxyphenyl)amino]-2-oxidanyl-propyl]azanium sulfate Openeye Name: [amino(azaniumyl)methylene]-[2-hydroxy-3-(2-methoxyanilino)propyl]ammonium sulfate CAS Name: [amino(ammonio)methylidene]-[2-hydroxy-3-(2-methoxyanilino)propyl]ammonium sulfate IUPAC Name: [amino(azaniumyl)methylidene]-[2-hydroxy-3-(2-methoxyanilino)propyl]azanium sulfate Traditional Name: [amino(ammonio)methylene]-[2-hydroxy-3-(o-anisidino)propyl]ammonium sulfate Formula: C11H20N4O6S MolecularWeight: 336.3647

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NCC(C[NH+]=C([NH3+])N)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NCC(C[NH+]=C([NH3+])N)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C11H18N4O2.H2O4S/c1-17-10-5-3-2-4-9(10)14-6-8(16)7-15-11(12)13;1-5(2,3)4/h2-5,8,14,16H,6-7H2,1H3,(H4,12,13,15);(H2,1,2,3,4)