2,5-dimethoxy-4-(2-phosphonatoethylsulfonyl)aniline

Systemtic Name: 2,5-dimethoxy-4-(2-phosphonatoethylsulfonyl)aniline Openeye Name: 2,5-dimethoxy-4-(2-phosphonatoethylsulfonyl)aniline CAS Name: 2,5-dimethoxy-4-(2-phosphonatoethylsulfonyl)aniline IUPAC Name: 2,5-dimethoxy-4-(2-phosphonatoethylsulfonyl)aniline Traditional Name: [2,5-dimethoxy-4-(2-phosphonatoethylsulfonyl)phenyl]amine Formula: C10H14NO7PS-2 MolecularWeight: 323.259421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1N)OC)S(=O)(=O)CCP(=O)([O-])[O-]

Isomeric SMILES

COC1=CC(=C(C=C1N)OC)S(=O)(=O)CCP(=O)([O-])[O-]

InChI

InChI=1S/C10H16NO7PS/c1-17-8-6-10(9(18-2)5-7(8)11)20(15,16)4-3-19(12,13)14/h5-6H,3-4,11H2,1-2H3,(H2,12,13,14)/p-2