5-oxidanylidene-3-phenyl-tridecanoic acid

Systemtic Name: 5-oxidanylidene-3-phenyl-tridecanoic acid Openeye Name: 5-oxo-3-phenyl-tridecanoic acid CAS Name: 5-oxo-3-phenyltridecanoic acid IUPAC Name: 5-oxo-3-phenyltridecanoic acid Traditional Name: 5-keto-3-phenyl-tridecanoic acid Formula: C19H28O3 MolecularWeight: 304.42382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)CC(CC(=O)O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCC(=O)CC(CC(=O)O)C1=CC=CC=C1

InChI

InChI=1S/C19H28O3/c1-2-3-4-5-6-10-13-18(20)14-17(15-19(21)22)16-11-8-7-9-12-16/h7-9,11-12,17H,2-6,10,13-15H2,1H3,(H,21,22)