3-[1-(2-methylpropanoyloxy)ethyl]benzoic acid

Systemtic Name: 3-[1-(2-methylpropanoyloxy)ethyl]benzoic acid Openeye Name: 3-[1-(2-methylpropanoyloxy)ethyl]benzoic acid CAS Name: 3-[1-(2-methyl-1-oxopropoxy)ethyl]benzoic acid IUPAC Name: 3-[1-(2-methylpropanoyloxy)ethyl]benzoic acid Traditional Name: 3-(1-isobutyryloxyethyl)benzoic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC(C)C1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CC(C)C(=O)OC(C)C1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C13H16O4/c1-8(2)13(16)17-9(3)10-5-4-6-11(7-10)12(14)15/h4-9H,1-3H3,(H,14,15)