2-[(4-cyanophenyl)methyl]pent-4-enoic acid

Systemtic Name: 2-[(4-cyanophenyl)methyl]pent-4-enoic acid Openeye Name: 2-[(4-cyanophenyl)methyl]pent-4-enoic acid CAS Name: 2-[(4-cyanophenyl)methyl]-4-pentenoic acid IUPAC Name: 2-[(4-cyanophenyl)methyl]pent-4-enoic acid Traditional Name: 2-(4-cyanobenzyl)pent-4-enoic acid Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC1=CC=C(C=C1)C#N)C(=O)O

Isomeric SMILES

C=CCC(CC1=CC=C(C=C1)C#N)C(=O)O

InChI

InChI=1S/C13H13NO2/c1-2-3-12(13(15)16)8-10-4-6-11(9-14)7-5-10/h2,4-7,12H,1,3,8H2,(H,15,16)