2-[4-(4-cyanophenyl)butyl]benzoic acid

Systemtic Name: 2-[4-(4-cyanophenyl)butyl]benzoic acid Openeye Name: 2-[4-(4-cyanophenyl)butyl]benzoic acid CAS Name: 2-[4-(4-cyanophenyl)butyl]benzoic acid IUPAC Name: 2-[4-(4-cyanophenyl)butyl]benzoic acid Traditional Name: 2-[4-(4-cyanophenyl)butyl]benzoic acid Formula: C18H17NO2 MolecularWeight: 279.33308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCCCC2=CC=C(C=C2)C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CCCCC2=CC=C(C=C2)C#N)C(=O)O

InChI

InChI=1S/C18H17NO2/c19-13-15-11-9-14(10-12-15)5-1-2-6-16-7-3-4-8-17(16)18(20)21/h3-4,7-12H,1-2,5-6H2,(H,20,21)