tetrasodium (2-methyl-4-phosphonatooxy-naphthalen-1-yl) phosphate

Systemtic Name: tetrasodium (2-methyl-4-phosphonatooxy-naphthalen-1-yl) phosphate Openeye Name: tetrasodium (2-methyl-4-phosphonatooxy-1-naphthyl) phosphate CAS Name: tetrasodium (2-methyl-4-phosphonatooxy-1-naphthalenyl) phosphate IUPAC Name: tetrasodium (2-methyl-4-phosphonatooxynaphthalen-1-yl) phosphate Traditional Name: tetrasodium (2-methyl-4-phosphato-1-naphthyl) phosphate Formula: C11H8Na4O8P2 MolecularWeight: 422.083022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C(=C1)OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

CC1=C(C2=CC=CC=C2C(=C1)OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C11H12O8P2.4Na/c1-7-6-10(18-20(12,13)14)8-4-2-3-5-9(8)11(7)19-21(15,16)17;;;;/h2-6H,1H3,(H2,12,13,14)(H2,15,16,17);;;;/q;4*+1/p-4