1,7,8-tricarboxyoxyoctan-2-yl hydrogen carbonate

Systemtic Name: 1,7,8-tricarboxyoxyoctan-2-yl hydrogen carbonate Openeye Name: [6,7-dicarboxyoxy-1-(carboxyoxymethyl)heptyl] hydrogen carbonate CAS Name: carbonic acid 1,7,8-tricarboxyoxyoctan-2-yl ester IUPAC Name: 1,7,8-tricarboxyoxyoctan-2-yl hydrogen carbonate Traditional Name: carbonic acid [6,7-dicarboxyoxy-1-(carboxyoxymethyl)heptyl] ester Formula: C12H18O12 MolecularWeight: 354.26412

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(COC(=O)O)OC(=O)O)CC(COC(=O)O)OC(=O)O

Isomeric SMILES

C(CCC(COC(=O)O)OC(=O)O)CC(COC(=O)O)OC(=O)O

InChI

InChI=1S/C12H18O12/c13-9(14)21-5-7(23-11(17)18)3-1-2-4-8(24-12(19)20)6-22-10(15)16/h7-8H,1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20)