3-(12-methoxy-3-oxidanylidene-dodecanoyl)benzoic acid

Systemtic Name: 3-(12-methoxy-3-oxidanylidene-dodecanoyl)benzoic acid Openeye Name: 3-(12-methoxy-3-oxo-dodecanoyl)benzoic acid CAS Name: 3-(12-methoxy-1,3-dioxododecyl)benzoic acid IUPAC Name: 3-(12-methoxy-3-oxododecanoyl)benzoic acid Traditional Name: 3-(3-keto-12-methoxy-dodecanoyl)benzoic acid Formula: C20H28O5 MolecularWeight: 348.43332

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCCCCCCC(=O)CC(=O)C1=CC(=CC=C1)C(=O)O

Isomeric SMILES

COCCCCCCCCCC(=O)CC(=O)C1=CC(=CC=C1)C(=O)O

InChI

InChI=1S/C20H28O5/c1-25-13-8-6-4-2-3-5-7-12-18(21)15-19(22)16-10-9-11-17(14-16)20(23)24/h9-11,14H,2-8,12-13,15H2,1H3,(H,23,24)