2-ethyl-9,10-bis(oxidanylidene)anthracene-1-sulfonic acid

Systemtic Name: 2-ethyl-9,10-bis(oxidanylidene)anthracene-1-sulfonic acid Openeye Name: 2-ethyl-9,10-dioxo-anthracene-1-sulfonic acid CAS Name: 2-ethyl-9,10-dioxo-1-anthracenesulfonic acid IUPAC Name: 2-ethyl-9,10-dioxoanthracene-1-sulfonic acid Traditional Name: 2-ethyl-9,10-diketo-anthracene-1-sulfonic acid Formula: C16H12O5S MolecularWeight: 316.32848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)O

Isomeric SMILES

CCC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)O

InChI

InChI=1S/C16H12O5S/c1-2-9-7-8-12-13(16(9)22(19,20)21)15(18)11-6-4-3-5-10(11)14(12)17/h3-8H,2H2,1H3,(H,19,20,21)