4-(1-butanoyloxyethyl)benzoic acid

Systemtic Name: 4-(1-butanoyloxyethyl)benzoic acid Openeye Name: 4-(1-butanoyloxyethyl)benzoic acid CAS Name: 4-[1-(1-oxobutoxy)ethyl]benzoic acid IUPAC Name: 4-(1-butanoyloxyethyl)benzoic acid Traditional Name: 4-(1-butyryloxyethyl)benzoic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4/c1-3-4-12(14)17-9(2)10-5-7-11(8-6-10)13(15)16/h5-9H,3-4H2,1-2H3,(H,15,16)