4-[4-(2-methylbutanoyloxy)phenyl]benzoic acid

Systemtic Name: 4-[4-(2-methylbutanoyloxy)phenyl]benzoic acid Openeye Name: 4-[4-(2-methylbutanoyloxy)phenyl]benzoic acid CAS Name: 4-[4-(2-methyl-1-oxobutoxy)phenyl]benzoic acid IUPAC Name: 4-[4-(2-methylbutanoyloxy)phenyl]benzoic acid Traditional Name: 4-[4-(2-methylbutanoyloxy)phenyl]benzoic acid Formula: C18H18O4 MolecularWeight: 298.33312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC(C)C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H18O4/c1-3-12(2)18(21)22-16-10-8-14(9-11-16)13-4-6-15(7-5-13)17(19)20/h4-12H,3H2,1-2H3,(H,19,20)