6,13-bis(oxidanylidene)pentacene-1-sulfonic acid

Systemtic Name: 6,13-bis(oxidanylidene)pentacene-1-sulfonic acid Openeye Name: 6,13-dioxopentacene-1-sulfonic acid CAS Name: 6,13-dioxo-1-pentacenesulfonic acid IUPAC Name: 6,13-dioxopentacene-1-sulfonic acid Traditional Name: 6,13-diketopentacene-1-sulfonic acid Formula: C22H12O5S MolecularWeight: 388.39268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C(=CC2=C1)C(=O)C4=C(C3=O)C=C5C(=C4)C=CC=C5S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C=C3C(=CC2=C1)C(=O)C4=C(C3=O)C=C5C(=C4)C=CC=C5S(=O)(=O)O

InChI

InChI=1S/C22H12O5S/c23-21-16-8-12-4-1-2-5-13(12)9-17(16)22(24)19-11-15-14(10-18(19)21)6-3-7-20(15)28(25,26)27/h1-11H,(H,25,26,27)