2-[4-(3-cyanopropoxy)phenyl]ethanoic acid

Systemtic Name: 2-[4-(3-cyanopropoxy)phenyl]ethanoic acid Openeye Name: 2-[4-(3-cyanopropoxy)phenyl]acetic acid CAS Name: 2-[4-(3-cyanopropoxy)phenyl]acetic acid IUPAC Name: 2-[4-(3-cyanopropoxy)phenyl]acetic acid Traditional Name: 2-[4-(3-cyanopropoxy)phenyl]acetic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)OCCCC#N

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)OCCCC#N

InChI

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