(Z)-1-(7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)-2-[4-[(E)-2-(7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)-2-sulfo-ethenyl]phenyl]ethenesulfonic acid

Systemtic Name: (Z)-1-(7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)-2-[4-[(E)-2-(7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)-2-sulfo-ethenyl]phenyl]ethenesulfonic acid Openeye Name: (Z)-1-(7,7-dimethyl-2-oxo-norbornan-1-yl)-2-[4-[(E)-2-(7,7-dimethyl-2-oxo-norbornan-1-yl)-2-sulfo-vinyl]phenyl]ethenesulfonic acid CAS Name: (Z)-1-(7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)-2-[4-[(E)-2-(7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)-2-sulfoethenyl]phenyl]ethenesulfonic acid IUPAC Name: (Z)-1-(7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)-2-[4-[(E)-2-(7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)-2-sulfoethenyl]phenyl]ethenesulfonic acid Traditional Name: (Z)-1-(2-keto-7,7-dimethyl-norbornan-1-yl)-2-[4-[(E)-2-(2-keto-7,7-dimethyl-norbornan-1-yl)-2-sulfo-vinyl]phenyl]ethenesulfonic acid Formula: C28H34O8S2 MolecularWeight: 562.69476

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=O)C2)C(=CC3=CC=C(C=C3)C=C(C45CCC(C4(C)C)CC5=O)S(=O)(=O)O)S(=O)(=O)O)C

Isomeric SMILES

CC1(C2CCC1(C(=O)C2)/C(=C\C3=CC=C(C=C3)/C=C(/C45CCC(C4(C)C)CC5=O)\S(=O)(=O)O)/S(=O)(=O)O)C

InChI

InChI=1S/C28H34O8S2/c1-25(2)19-9-11-27(25,21(29)15-19)23(37(31,32)33)13-17-5-7-18(8-6-17)14-24(38(34,35)36)28-12-10-20(16-22(28)30)26(28,3)4/h5-8,13-14,19-20H,9-12,15-16H2,1-4H3,(H,31,32,33)(H,34,35,36)/b23-13-,24-14+