2,2-bis(hydroxymethyl)-5-oxidanylidene-5-phenyl-pentanoic acid

Systemtic Name: 2,2-bis(hydroxymethyl)-5-oxidanylidene-5-phenyl-pentanoic acid Openeye Name: 2,2-bis(hydroxymethyl)-5-oxo-5-phenyl-pentanoic acid CAS Name: 2,2-bis(hydroxymethyl)-5-oxo-5-phenylpentanoic acid IUPAC Name: 2,2-bis(hydroxymethyl)-5-oxo-5-phenylpentanoic acid Traditional Name: 5-keto-2,2-dimethylol-5-phenyl-valeric acid Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCC(CO)(CO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCC(CO)(CO)C(=O)O

InChI

InChI=1S/C13H16O5/c14-8-13(9-15,12(17)18)7-6-11(16)10-4-2-1-3-5-10/h1-5,14-15H,6-9H2,(H,17,18)