2-methoxy-3-[(2-methoxy-3-sulfo-phenyl)methyl]benzenesulfonic acid

Systemtic Name: 2-methoxy-3-[(2-methoxy-3-sulfo-phenyl)methyl]benzenesulfonic acid Openeye Name: 2-methoxy-3-[(2-methoxy-3-sulfo-phenyl)methyl]benzenesulfonic acid CAS Name: 2-methoxy-3-[(2-methoxy-3-sulfophenyl)methyl]benzenesulfonic acid IUPAC Name: 2-methoxy-3-[(2-methoxy-3-sulfophenyl)methyl]benzenesulfonic acid Traditional Name: 2-methoxy-3-(2-methoxy-3-sulfo-benzyl)besylic acid Formula: C15H16O8S2 MolecularWeight: 388.41274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=C1S(=O)(=O)O)CC2=C(C(=CC=C2)S(=O)(=O)O)OC

Isomeric SMILES

COC1=C(C=CC=C1S(=O)(=O)O)CC2=C(C(=CC=C2)S(=O)(=O)O)OC

InChI

InChI=1S/C15H16O8S2/c1-22-14-10(5-3-7-12(14)24(16,17)18)9-11-6-4-8-13(15(11)23-2)25(19,20)21/h3-8H,9H2,1-2H3,(H,16,17,18)(H,19,20,21)