[2-carboxylatooxy-4-[2-(4-carboxylatooxy-3-carboxyoxy-phenyl)ethyl]phenyl] carbonate

Systemtic Name: [2-carboxylatooxy-4-[2-(4-carboxylatooxy-3-carboxyoxy-phenyl)ethyl]phenyl] carbonate Openeye Name: [2-carboxylatooxy-4-[2-(4-carboxylatooxy-3-carboxyoxy-phenyl)ethyl]phenyl] carbonate CAS Name: [2-carboxylatooxy-4-[2-(4-carboxylatooxy-3-carboxyoxyphenyl)ethyl]phenyl] carbonate IUPAC Name: [2-carboxylatooxy-4-[2-(4-carboxylatooxy-3-carboxyoxyphenyl)ethyl]phenyl] carbonate Traditional Name: [2-carboxylatooxy-4-[2-(4-carboxylatooxy-3-carboxyoxy-phenyl)ethyl]phenyl] carbonate Formula: C18H11O12-3 MolecularWeight: 419.27274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCC2=CC(=C(C=C2)OC(=O)[O-])OC(=O)[O-])OC(=O)O)OC(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1CCC2=CC(=C(C=C2)OC(=O)[O-])OC(=O)[O-])OC(=O)O)OC(=O)[O-]

InChI

InChI=1S/C18H14O12/c19-15(20)27-11-5-3-9(7-13(11)29-17(23)24)1-2-10-4-6-12(28-16(21)22)14(8-10)30-18(25)26/h3-8H,1-2H2,(H,19,20)(H,21,22)(H,23,24)(H,25,26)/p-3