disodium phenethyl phosphate

Systemtic Name: disodium phenethyl phosphate Openeye Name: disodium phenethyl phosphate CAS Name: disodium phenethyl phosphate IUPAC Name: disodium phenethyl phosphate Traditional Name: disodium phenethyl phosphate Formula: C8H9Na2O4P MolecularWeight: 248.107721

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOP(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CC[18O]P(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C8H11O4P.2Na/c9-13(10,11)12-7-6-8-4-2-1-3-5-8;;/h1-5H,6-7H2,(H2,9,10,11);;/q;2*+1/p-2/i12+2;;