4-phenylbutanoic acid; sodium

Systemtic Name: 4-phenylbutanoic acid; sodium Openeye Name: 4-phenylbutanoic acid; sodium CAS Name: 4-phenylbutanoic acid; sodium IUPAC Name: 4-phenylbutanoic acid; sodium Traditional Name: 4-phenylbutyric acid; sodium Formula: C10H12NaO2 MolecularWeight: 187.19085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(=O)O.[Na]

Isomeric SMILES

C1=CC=C(C=C1)CCCC(=O)O.[Na]

InChI

InChI=1S/C10H12O2.Na/c11-10(12)8-4-7-9-5-2-1-3-6-9;/h1-3,5-6H,4,7-8H2,(H,11,12);