5-(3-cyanophenoxy)pentanoate

Systemtic Name: 5-(3-cyanophenoxy)pentanoate Openeye Name: 5-(3-cyanophenoxy)pentanoate CAS Name: 5-(3-cyanophenoxy)pentanoate IUPAC Name: 5-(3-cyanophenoxy)pentanoate Traditional Name: 5-(3-cyanophenoxy)valerate Formula: C12H12NO3- MolecularWeight: 218.22858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCCC(=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)OCCCCC(=O)[O-])C#N

InChI

InChI=1S/C12H13NO3/c13-9-10-4-3-5-11(8-10)16-7-2-1-6-12(14)15/h3-5,8H,1-2,6-7H2,(H,14,15)/p-1