benzaldehyde; 2,6-dimethoxy-4-methyl-benzenesulfonic acid

Systemtic Name: benzaldehyde; 2,6-dimethoxy-4-methyl-benzenesulfonic acid Openeye Name: benzaldehyde; 2,6-dimethoxy-4-methyl-benzenesulfonic acid CAS Name: benzaldehyde; 2,6-dimethoxy-4-methylbenzenesulfonic acid IUPAC Name: benzaldehyde; 2,6-dimethoxy-4-methylbenzenesulfonic acid Traditional Name: benzaldehyde; 2,6-dimethoxy-4-methyl-besylic acid Formula: C16H18O6S MolecularWeight: 338.37552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC)S(=O)(=O)O)OC.C1=CC=C(C=C1)C=O

Isomeric SMILES

CC1=CC(=C(C(=C1)OC)S(=O)(=O)O)OC.C1=CC=C(C=C1)C=O

InChI

InChI=1S/C9H12O5S.C7H6O/c1-6-4-7(13-2)9(15(10,11)12)8(5-6)14-3;8-6-7-4-2-1-3-5-7/h4-5H,1-3H3,(H,10,11,12);1-6H