N1-(2-phosphonatoethyl)-2-(2-phosphonatoethylsulfonyl)benzene-1,4-diamine

Systemtic Name: N1-(2-phosphonatoethyl)-2-(2-phosphonatoethylsulfonyl)benzene-1,4-diamine Openeye Name: N1-(2-phosphonatoethyl)-2-(2-phosphonatoethylsulfonyl)benzene-1,4-diamine CAS Name: N1-(2-phosphonatoethyl)-2-(2-phosphonatoethylsulfonyl)benzene-1,4-diamine IUPAC Name: 1-N-(2-phosphonatoethyl)-2-(2-phosphonatoethylsulfonyl)benzene-1,4-diamine Traditional Name: [4-amino-2-(2-phosphonatoethylsulfonyl)phenyl]-(2-phosphonatoethyl)amine Formula: C10H14N2O8P2S-4 MolecularWeight: 384.239282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)S(=O)(=O)CCP(=O)([O-])[O-])NCCP(=O)([O-])[O-]

Isomeric SMILES

C1=CC(=C(C=C1N)S(=O)(=O)CCP(=O)([O-])[O-])NCCP(=O)([O-])[O-]

InChI

InChI=1S/C10H18N2O8P2S/c11-8-1-2-9(12-3-4-21(13,14)15)10(7-8)23(19,20)6-5-22(16,17)18/h1-2,7,12H,3-6,11H2,(H2,13,14,15)(H2,16,17,18)/p-4