2-butyl-3-(phenylcarbonyl)benzoate

Systemtic Name: 2-butyl-3-(phenylcarbonyl)benzoate Openeye Name: 3-benzoyl-2-butyl-benzoate CAS Name: 3-benzoyl-2-butylbenzoate IUPAC Name: 3-benzoyl-2-butylbenzoate Traditional Name: 3-benzoyl-2-butyl-benzoate Formula: C18H17O3- MolecularWeight: 281.32578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC=C1C(=O)[O-])C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=C(C=CC=C1C(=O)[O-])C(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H18O3/c1-2-3-10-14-15(11-7-12-16(14)18(20)21)17(19)13-8-5-4-6-9-13/h4-9,11-12H,2-3,10H2,1H3,(H,20,21)/p-1