[1,8-bis(chloranyl)anthracen-9-yl] 4-methoxybenzenesulfonate

Systemtic Name: [1,8-bis(chloranyl)anthracen-9-yl] 4-methoxybenzenesulfonate Openeye Name: (1,8-dichloro-9-anthryl) 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid (1,8-dichloro-9-anthracenyl) ester IUPAC Name: (1,8-dichloroanthracen-9-yl) 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid (1,8-dichloro-9-anthryl) ester Formula: C21H14Cl2O4S MolecularWeight: 433.30446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=CC4=C2C(=CC=C4)Cl)C=CC=C3Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=CC4=C2C(=CC=C4)Cl)C=CC=C3Cl

InChI

InChI=1S/C21H14Cl2O4S/c1-26-15-8-10-16(11-9-15)28(24,25)27-21-19-13(4-2-6-17(19)22)12-14-5-3-7-18(23)20(14)21/h2-12H,1H3