(4-methoxycarbonylphenyl)azanium sulfate

Systemtic Name: (4-methoxycarbonylphenyl)azanium sulfate Openeye Name: (4-methoxycarbonylphenyl)ammonium sulfate CAS Name: (4-methoxycarbonylphenyl)ammonium sulfate IUPAC Name: (4-methoxycarbonylphenyl)azanium sulfate Traditional Name: (4-carbomethoxyphenyl)ammonium sulfate Formula: C16H20N2O8S MolecularWeight: 400.4036

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)[NH3+].COC(=O)C1=CC=C(C=C1)[NH3+].[O-]S(=O)(=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)[NH3+].COC(=O)C1=CC=C(C=C1)[NH3+].[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C8H9NO2.H2O4S/c2*1-11-8(10)6-2-4-7(9)5-3-6;1-5(2,3)4/h2*2-5H,9H2,1H3;(H2,1,2,3,4)