9,10-dicyanoanthracene-2-sulfonic acid

Systemtic Name: 9,10-dicyanoanthracene-2-sulfonic acid Openeye Name: 9,10-dicyanoanthracene-2-sulfonic acid CAS Name: 9,10-dicyano-2-anthracenesulfonic acid IUPAC Name: 9,10-dicyanoanthracene-2-sulfonic acid Traditional Name: 9,10-dicyanoanthracene-2-sulfonic acid Formula: C16H8N2O3S MolecularWeight: 308.31132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC(=CC3=C2C#N)S(=O)(=O)O)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC(=CC3=C2C#N)S(=O)(=O)O)C#N

InChI

InChI=1S/C16H8N2O3S/c17-8-15-11-3-1-2-4-12(11)16(9-18)14-7-10(22(19,20)21)5-6-13(14)15/h1-7H,(H,19,20,21)