3-oxidanylidene-5-phenylmethoxy-nonanoic acid

Systemtic Name: 3-oxidanylidene-5-phenylmethoxy-nonanoic acid Openeye Name: 5-benzyloxy-3-oxo-nonanoic acid CAS Name: 3-oxo-5-phenylmethoxynonanoic acid IUPAC Name: 3-oxo-5-phenylmethoxynonanoic acid Traditional Name: 5-benzoxy-3-keto-pelargonic acid Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)CC(=O)O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCC(CC(=O)CC(=O)O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H22O4/c1-2-3-9-15(10-14(17)11-16(18)19)20-12-13-7-5-4-6-8-13/h4-8,15H,2-3,9-12H2,1H3,(H,18,19)