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7,12-dimethylbenzo[a]anthracene-8,10-disulfonic acid

7,12-dimethylbenzo[a]anthracene-8,10-disulfonic acid

Systemtic Name:7,12-dimethylbenzo[a]anthracene-8,10-disulfonic acid
Openeye Name:7,12-dimethylbenzo[a]anthracene-8,10-disulfonic acid
CAS Name:7,12-dimethylbenzo[a]anthracene-8,10-disulfonic acid
IUPAC Name:7,12-dimethylbenzo[a]anthracene-8,10-disulfonic acid
Traditional Name:7,12-dimethylbenz[a]anthracene-8,10-disulfonic acid
Formula: C20H16O6S2
MolecularWeight: 416.46744
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC3=CC=CC=C3C2=C(C4=CC(=CC(=C14)S(=O)(=O)O)S(=O)(=O)O)C


Isomeric SMILES

CC1=C2C=CC3=CC=CC=C3C2=C(C4=CC(=CC(=C14)S(=O)(=O)O)S(=O)(=O)O)C


InChI

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


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