3-cyano-4-(2-methylbutoxy)benzoic acid

Systemtic Name: 3-cyano-4-(2-methylbutoxy)benzoic acid Openeye Name: 3-cyano-4-(2-methylbutoxy)benzoic acid CAS Name: 3-cyano-4-(2-methylbutoxy)benzoic acid IUPAC Name: 3-cyano-4-(2-methylbutoxy)benzoic acid Traditional Name: 3-cyano-4-(2-methylbutoxy)benzoic acid Formula: C13H15NO3 MolecularWeight: 233.2631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC1=C(C=C(C=C1)C(=O)O)C#N

Isomeric SMILES

CCC(C)COC1=C(C=C(C=C1)C(=O)O)C#N

InChI

InChI=1S/C13H15NO3/c1-3-9(2)8-17-12-5-4-10(13(15)16)6-11(12)7-14/h4-6,9H,3,8H2,1-2H3,(H,15,16)