[4,5-bis(oxidanyl)-7-(sulfomethyl)naphthalen-2-yl]methanesulfonic acid

Systemtic Name: [4,5-bis(oxidanyl)-7-(sulfomethyl)naphthalen-2-yl]methanesulfonic acid Openeye Name: [4,5-dihydroxy-7-(sulfomethyl)-2-naphthyl]methanesulfonic acid CAS Name: [4,5-dihydroxy-7-(sulfomethyl)-2-naphthalenyl]methanesulfonic acid IUPAC Name: [4,5-dihydroxy-7-(sulfomethyl)naphthalen-2-yl]methanesulfonic acid Traditional Name: [4,5-dihydroxy-7-(sulfomethyl)-2-naphthyl]methanesulfonic acid Formula: C12H12O8S2 MolecularWeight: 348.34888

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C(C=C(C=C21)CS(=O)(=O)O)O)O)CS(=O)(=O)O

Isomeric SMILES

C1=C(C=C(C2=C(C=C(C=C21)CS(=O)(=O)O)O)O)CS(=O)(=O)O

InChI

InChI=1S/C12H12O8S2/c13-10-3-7(5-21(15,16)17)1-9-2-8(6-22(18,19)20)4-11(14)12(9)10/h1-4,13-14H,5-6H2,(H,15,16,17)(H,18,19,20)