1-[(2,5-dimethoxyphenyl)methyl]ethane-1,1,2-tricarboxylic acid

Systemtic Name: 1-[(2,5-dimethoxyphenyl)methyl]ethane-1,1,2-tricarboxylic acid Openeye Name: 1-[(2,5-dimethoxyphenyl)methyl]ethane-1,1,2-tricarboxylic acid CAS Name: 1-[(2,5-dimethoxyphenyl)methyl]ethane-1,1,2-tricarboxylic acid IUPAC Name: 1-[(2,5-dimethoxyphenyl)methyl]ethane-1,1,2-tricarboxylic acid Traditional Name: 1-(2,5-dimethoxybenzyl)ethane-1,1,2-tricarboxylic acid Formula: C14H16O8 MolecularWeight: 312.27204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CC(CC(=O)O)(C(=O)O)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CC(CC(=O)O)(C(=O)O)C(=O)O

InChI

InChI=1S/C14H16O8/c1-21-9-3-4-10(22-2)8(5-9)6-14(12(17)18,13(19)20)7-11(15)16/h3-5H,6-7H2,1-2H3,(H,15,16)(H,17,18)(H,19,20)