hexasodium 2-(6-methoxynaphthalen-2-yl)propane-1,1-diolate tetrahydroxide

Systemtic Name: hexasodium 2-(6-methoxynaphthalen-2-yl)propane-1,1-diolate tetrahydroxide Openeye Name: hexasodium 2-(6-methoxy-2-naphthyl)propane-1,1-diolate tetrahydroxide CAS Name: hexasodium 2-(6-methoxy-2-naphthalenyl)propane-1,1-diolate tetrahydroxide IUPAC Name: hexasodium 2-(6-methoxynaphthalen-2-yl)propane-1,1-diolate tetrahydroxide Traditional Name: hexasodium 2-(6-methoxy-2-naphthyl)propane-1,1-diolate tetrahydroxide Formula: C28H32Na6O10-2 MolecularWeight: 666.4863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C([O-])[O-].CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C([O-])[O-].[OH-].[OH-].[OH-].[OH-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C([O-])[O-].CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C([O-])[O-].[OH-].[OH-].[OH-].[OH-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/2C14H14O3.6Na.4H2O/c2*1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10;;;;;;;;;;/h2*3-9,14H,1-2H3;;;;;;;4*1H2/q2*-2;6*+1;;;;/p-4