2-(2-methoxy-2-oxidanylidene-1-phenyl-ethyl)octanoic acid

Systemtic Name: 2-(2-methoxy-2-oxidanylidene-1-phenyl-ethyl)octanoic acid Openeye Name: 2-(2-methoxy-2-oxo-1-phenyl-ethyl)octanoic acid CAS Name: 2-(2-methoxy-2-oxo-1-phenylethyl)octanoic acid IUPAC Name: 2-(2-methoxy-2-oxo-1-phenylethyl)octanoic acid Traditional Name: 2-(2-keto-2-methoxy-1-phenyl-ethyl)caprylic acid Formula: C17H24O4 MolecularWeight: 292.37006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C1=CC=CC=C1)C(=O)OC)C(=O)O

Isomeric SMILES

CCCCCCC(C(C1=CC=CC=C1)C(=O)OC)C(=O)O

InChI

InChI=1S/C17H24O4/c1-3-4-5-9-12-14(16(18)19)15(17(20)21-2)13-10-7-6-8-11-13/h6-8,10-11,14-15H,3-5,9,12H2,1-2H3,(H,18,19)