(2R)-2-[(4-carboxyphenyl)methyl]-2-oxidanyl-butanedioic acid

Systemtic Name: (2R)-2-[(4-carboxyphenyl)methyl]-2-oxidanyl-butanedioic acid Openeye Name: (2R)-2-[(4-carboxyphenyl)methyl]-2-hydroxy-butanedioic acid CAS Name: (2R)-2-[(4-carboxyphenyl)methyl]-2-hydroxybutanedioic acid IUPAC Name: (2R)-2-[(4-carboxyphenyl)methyl]-2-hydroxybutanedioic acid Traditional Name: (2R)-2-(4-carboxybenzyl)-2-hydroxy-succinic acid Formula: C12H12O7 MolecularWeight: 268.21948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CC(=O)O)(C(=O)O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C[C@@](CC(=O)O)(C(=O)O)O)C(=O)O

InChI

InChI=1S/C12H12O7/c13-9(14)6-12(19,11(17)18)5-7-1-3-8(4-2-7)10(15)16/h1-4,19H,5-6H2,(H,13,14)(H,15,16)(H,17,18)/t12-/m1/s1