disodium 2-[10-(2-sulfonatooxyethyl)anthracen-9-yl]ethyl sulfate

Systemtic Name: disodium 2-[10-(2-sulfonatooxyethyl)anthracen-9-yl]ethyl sulfate Openeye Name: disodium 2-[10-(2-sulfonatooxyethyl)-9-anthryl]ethyl sulfate CAS Name: disodium 2-[10-(2-sulfonatooxyethyl)-9-anthracenyl]ethyl sulfate IUPAC Name: disodium 2-[10-(2-sulfonatooxyethyl)anthracen-9-yl]ethyl sulfate Traditional Name: disodium 2-[10-(2-sulfatoethyl)-9-anthryl]ethyl sulfate Formula: C18H16Na2O8S2 MolecularWeight: 470.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2CCOS(=O)(=O)[O-])CCOS(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2CCOS(=O)(=O)[O-])CCOS(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C18H18O8S2.2Na/c19-27(20,21)25-11-9-17-13-5-1-2-6-14(13)18(10-12-26-28(22,23)24)16-8-4-3-7-15(16)17;;/h1-8H,9-12H2,(H,19,20,21)(H,22,23,24);;/q;2*+1/p-2