(2S,3R)-2-oxidanyl-3-(phenylmethoxymethyl)butanedioic acid

Systemtic Name: (2S,3R)-2-oxidanyl-3-(phenylmethoxymethyl)butanedioic acid Openeye Name: (2R,3S)-2-(benzyloxymethyl)-3-hydroxy-butanedioic acid CAS Name: (2S,3R)-2-hydroxy-3-(phenylmethoxymethyl)butanedioic acid IUPAC Name: (2S,3R)-2-hydroxy-3-(phenylmethoxymethyl)butanedioic acid Traditional Name: (2R,3S)-2-(benzoxymethyl)-3-hydroxy-succinic acid Formula: C12H14O6 MolecularWeight: 254.23596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(C(C(=O)O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC[C@H]([C@@H](C(=O)O)O)C(=O)O

InChI

InChI=1S/C12H14O6/c13-10(12(16)17)9(11(14)15)7-18-6-8-4-2-1-3-5-8/h1-5,9-10,13H,6-7H2,(H,14,15)(H,16,17)/t9-,10+/m1/s1