2-[10-(2-sulfooxyethyl)anthracen-9-yl]ethyl hydrogen sulfate

Systemtic Name: 2-[10-(2-sulfooxyethyl)anthracen-9-yl]ethyl hydrogen sulfate Openeye Name: 2-[10-(2-sulfooxyethyl)-9-anthryl]ethyl hydrogen sulfate CAS Name: sulfuric acid 2-[10-(2-sulfooxyethyl)-9-anthracenyl]ethyl ester IUPAC Name: 2-[10-(2-sulfooxyethyl)anthracen-9-yl]ethyl hydrogen sulfate Traditional Name: sulfuric acid 2-[10-(2-sulfoxyethyl)-9-anthryl]ethyl ester Formula: C18H18O8S2 MolecularWeight: 426.46072

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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

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2CCOS(=O)(=O)O)CCOS(=O)(=O)O

InChI

InChI=1S/C18H18O8S2/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)