3,4-bis(oxidanyl)cyclohexa-1,5-diene-1,3-disulfonic acid; phenol

Systemtic Name: 3,4-bis(oxidanyl)cyclohexa-1,5-diene-1,3-disulfonic acid; phenol Openeye Name: 3,4-dihydroxycyclohexa-1,5-diene-1,3-disulfonic acid; phenol CAS Name: 3,4-dihydroxycyclohexa-1,5-diene-1,3-disulfonic acid; phenol IUPAC Name: 3,4-dihydroxycyclohexa-1,5-diene-1,3-disulfonic acid; phenol Traditional Name: 3,4-dihydroxycyclohexa-1,5-diene-1,3-disulfonic acid; phenol Formula: C12H14O9S2 MolecularWeight: 366.36416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)O.C1=CC(=CC(C1O)(O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)O.C1=CC(=CC(C1O)(O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C6H8O8S2.C6H6O/c7-5-2-1-4(15(9,10)11)3-6(5,8)16(12,13)14;7-6-4-2-1-3-5-6/h1-3,5,7-8H,(H,9,10,11)(H,12,13,14);1-5,7H