2-(phenylmethyl)oxane-2-carboxylic acid

Systemtic Name: 2-(phenylmethyl)oxane-2-carboxylic acid Openeye Name: 2-benzyltetrahydropyran-2-carboxylic acid CAS Name: 2-(phenylmethyl)-2-oxanecarboxylic acid IUPAC Name: 2-benzyloxane-2-carboxylic acid Traditional Name: 2-benzyltetrahydropyran-2-carboxylic acid Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CCOC(C1)(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C13H16O3/c14-12(15)13(8-4-5-9-16-13)10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,(H,14,15)