2-(3-butyl-4-oxidanyl-phenyl)benzoic acid

Systemtic Name: 2-(3-butyl-4-oxidanyl-phenyl)benzoic acid Openeye Name: 2-(3-butyl-4-hydroxy-phenyl)benzoic acid CAS Name: 2-(3-butyl-4-hydroxyphenyl)benzoic acid IUPAC Name: 2-(3-butyl-4-hydroxyphenyl)benzoic acid Traditional Name: 2-(3-butyl-4-hydroxy-phenyl)benzoic acid Formula: C17H18O3 MolecularWeight: 270.32302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C2=CC=CC=C2C(=O)O)O

Isomeric SMILES

CCCCC1=C(C=CC(=C1)C2=CC=CC=C2C(=O)O)O

InChI

InChI=1S/C17H18O3/c1-2-3-6-13-11-12(9-10-16(13)18)14-7-4-5-8-15(14)17(19)20/h4-5,7-11,18H,2-3,6H2,1H3,(H,19,20)