(C-azaniumylcarbonimidoyl)-[(4-methoxynaphthalen-1-yl)methyl]azanium sulfate

Systemtic Name: (C-azaniumylcarbonimidoyl)-[(4-methoxynaphthalen-1-yl)methyl]azanium sulfate Openeye Name: (azaniumylcarbonimidoyl)-[(4-methoxy-1-naphthyl)methyl]ammonium sulfate CAS Name: [ammonio(imino)methyl]-[(4-methoxy-1-naphthalenyl)methyl]ammonium sulfate IUPAC Name: (C-azaniumylcarbonimidoyl)-[(4-methoxynaphthalen-1-yl)methyl]azanium sulfate Traditional Name: (ammoniocarbonimidoyl)-[(4-methoxy-1-naphthyl)methyl]ammonium sulfate Formula: C13H17N3O5S MolecularWeight: 327.35618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C2=CC=CC=C21)C[NH2+]C(=N)[NH3+].[O-]S(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=C(C2=CC=CC=C21)C[NH2+]C(=N)[NH3+].[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C13H15N3O.H2O4S/c1-17-12-7-6-9(8-16-13(14)15)10-4-2-3-5-11(10)12;1-5(2,3)4/h2-7H,8H2,1H3,(H4,14,15,16);(H2,1,2,3,4)