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

Systemtic Name: 2-dodecyl-9,10-bis(oxidanylidene)anthracene-1-sulfonic acid Openeye Name: 2-dodecyl-9,10-dioxo-anthracene-1-sulfonic acid CAS Name: 2-dodecyl-9,10-dioxo-1-anthracenesulfonic acid IUPAC Name: 2-dodecyl-9,10-dioxoanthracene-1-sulfonic acid Traditional Name: 9,10-diketo-2-lauryl-anthracene-1-sulfonic acid Formula: C26H32O5S MolecularWeight: 456.59428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)O

InChI

InChI=1S/C26H32O5S/c1-2-3-4-5-6-7-8-9-10-11-14-19-17-18-22-23(26(19)32(29,30)31)25(28)21-16-13-12-15-20(21)24(22)27/h12-13,15-18H,2-11,14H2,1H3,(H,29,30,31)