5-(4-cyano-2-methoxy-phenoxy)pentanoic acid

Systemtic Name: 5-(4-cyano-2-methoxy-phenoxy)pentanoic acid Openeye Name: 5-(4-cyano-2-methoxy-phenoxy)pentanoic acid CAS Name: 5-(4-cyano-2-methoxyphenoxy)pentanoic acid IUPAC Name: 5-(4-cyano-2-methoxyphenoxy)pentanoic acid Traditional Name: 5-(4-cyano-2-methoxy-phenoxy)valeric acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OCCCCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OCCCCC(=O)O

InChI

InChI=1S/C13H15NO4/c1-17-12-8-10(9-14)5-6-11(12)18-7-3-2-4-13(15)16/h5-6,8H,2-4,7H2,1H3,(H,15,16)