2-(3-phenylmethoxypropyl)propanedioic acid

Systemtic Name: 2-(3-phenylmethoxypropyl)propanedioic acid Openeye Name: 2-(3-benzyloxypropyl)propanedioic acid CAS Name: 2-(3-phenylmethoxypropyl)propanedioic acid IUPAC Name: 2-(3-phenylmethoxypropyl)propanedioic acid Traditional Name: 2-(3-benzoxypropyl)malonic acid Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCC(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COCCCC(C(=O)O)C(=O)O

InChI

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