6-methylnaphthalene-1,3,5-trisulfonic acid

Systemtic Name: 6-methylnaphthalene-1,3,5-trisulfonic acid Openeye Name: 6-methylnaphthalene-1,3,5-trisulfonic acid CAS Name: 6-methylnaphthalene-1,3,5-trisulfonic acid IUPAC Name: 6-methylnaphthalene-1,3,5-trisulfonic acid Traditional Name: 6-methylnaphthalene-1,3,5-trisulfonic acid Formula: C11H10O9S3 MolecularWeight: 382.3867

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=CC(=C2C=C1)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=C(C2=CC(=CC(=C2C=C1)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C11H10O9S3/c1-6-2-3-8-9(11(6)23(18,19)20)4-7(21(12,13)14)5-10(8)22(15,16)17/h2-5H,1H3,(H,12,13,14)(H,15,16,17)(H,18,19,20)