7,12-dimethylbenzo[a]anthracene-1,9-disulfonic acid

Systemtic Name: 7,12-dimethylbenzo[a]anthracene-1,9-disulfonic acid Openeye Name: 7,12-dimethylbenzo[a]anthracene-1,9-disulfonic acid CAS Name: 7,12-dimethylbenzo[a]anthracene-1,9-disulfonic acid IUPAC Name: 7,12-dimethylbenzo[a]anthracene-1,9-disulfonic acid Traditional Name: 7,12-dimethylbenz[a]anthracene-1,9-disulfonic acid Formula: C20H16O6S2 MolecularWeight: 416.46744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=CC2=C(C3=C1C4=C(C=CC=C4S(=O)(=O)O)C=C3)C)S(=O)(=O)O

Isomeric SMILES

CC1=C2C=CC(=CC2=C(C3=C1C4=C(C=CC=C4S(=O)(=O)O)C=C3)C)S(=O)(=O)O

InChI

InChI=1S/C20H16O6S2/c1-11-16-8-6-13-4-3-5-18(28(24,25)26)20(13)19(16)12(2)15-9-7-14(10-17(11)15)27(21,22)23/h3-10H,1-2H3,(H,21,22,23)(H,24,25,26)