4-methyl-5-sulfino-benzene-1,3-disulfonic acid

Systemtic Name: 4-methyl-5-sulfino-benzene-1,3-disulfonic acid Openeye Name: 4-methyl-5-sulfino-benzene-1,3-disulfonic acid CAS Name: 4-methyl-5-sulfinobenzene-1,3-disulfonic acid IUPAC Name: 4-methyl-5-sulfinobenzene-1,3-disulfonic acid Traditional Name: 4-methyl-5-sulfino-benzene-1,3-disulfonic acid Formula: C7H8O8S3 MolecularWeight: 316.32862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1S(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1S(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C7H8O8S3/c1-4-6(16(8)9)2-5(17(10,11)12)3-7(4)18(13,14)15/h2-3H,1H3,(H,8,9)(H,10,11,12)(H,13,14,15)