5-butanoyl-2-(prop-2-enoxymethyl)benzoic acid

Systemtic Name: 5-butanoyl-2-(prop-2-enoxymethyl)benzoic acid Openeye Name: 2-(allyloxymethyl)-5-butanoyl-benzoic acid CAS Name: 5-(1-oxobutyl)-2-(prop-2-enoxymethyl)benzoic acid IUPAC Name: 5-butanoyl-2-(prop-2-enoxymethyl)benzoic acid Traditional Name: 2-(allyloxymethyl)-5-butyryl-benzoic acid Formula: C15H18O4 MolecularWeight: 262.30102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC(=C(C=C1)COCC=C)C(=O)O

Isomeric SMILES

CCCC(=O)C1=CC(=C(C=C1)COCC=C)C(=O)O

InChI

InChI=1S/C15H18O4/c1-3-5-14(16)11-6-7-12(10-19-8-4-2)13(9-11)15(17)18/h4,6-7,9H,2-3,5,8,10H2,1H3,(H,17,18)