3-(carboxymethyl)-7-nonyl-6-oxidanylidene-4,9-dioxaspiro[4.4]nonane-2,3-dicarboxylic acid

Systemtic Name: 3-(carboxymethyl)-7-nonyl-6-oxidanylidene-4,9-dioxaspiro[4.4]nonane-2,3-dicarboxylic acid Openeye Name: 3-(carboxymethyl)-7-nonyl-6-oxo-4,9-dioxaspiro[4.4]nonane-2,3-dicarboxylic acid CAS Name: 3-(carboxymethyl)-7-nonyl-6-oxo-4,9-dioxaspiro[4.4]nonane-2,3-dicarboxylic acid IUPAC Name: 3-(carboxymethyl)-7-nonyl-6-oxo-4,9-dioxaspiro[4.4]nonane-2,3-dicarboxylic acid Traditional Name: 3-(carboxymethyl)-6-keto-7-nonyl-4,9-dioxaspiro[4.4]nonane-2,3-dicarboxylic acid Formula: C20H30O9 MolecularWeight: 414.4468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1COC2(C1=O)CC(C(O2)(CC(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCC1COC2(C1=O)CC(C(O2)(CC(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C20H30O9/c1-2-3-4-5-6-7-8-9-13-12-28-20(16(13)23)10-14(17(24)25)19(29-20,18(26)27)11-15(21)22/h13-14H,2-12H2,1H3,(H,21,22)(H,24,25)(H,26,27)