2-methoxy-5-(2-phosphonatoethylsulfonyl)aniline

Systemtic Name: 2-methoxy-5-(2-phosphonatoethylsulfonyl)aniline Openeye Name: 2-methoxy-5-(2-phosphonatoethylsulfonyl)aniline CAS Name: 2-methoxy-5-(2-phosphonatoethylsulfonyl)aniline IUPAC Name: 2-methoxy-5-(2-phosphonatoethylsulfonyl)aniline Traditional Name: [2-methoxy-5-(2-phosphonatoethylsulfonyl)phenyl]amine Formula: C9H12NO6PS-2 MolecularWeight: 293.233441

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)CCP(=O)([O-])[O-])N

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)CCP(=O)([O-])[O-])N

InChI

InChI=1S/C9H14NO6PS/c1-16-9-3-2-7(6-8(9)10)18(14,15)5-4-17(11,12)13/h2-3,6H,4-5,10H2,1H3,(H2,11,12,13)/p-2