4-(2-butanoyloxypropyl)benzoic acid

Systemtic Name: 4-(2-butanoyloxypropyl)benzoic acid Openeye Name: 4-(2-butanoyloxypropyl)benzoic acid CAS Name: 4-[2-(1-oxobutoxy)propyl]benzoic acid IUPAC Name: 4-(2-butanoyloxypropyl)benzoic acid Traditional Name: 4-(2-butyryloxypropyl)benzoic acid Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C)CC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCCC(=O)OC(C)CC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C14H18O4/c1-3-4-13(15)18-10(2)9-11-5-7-12(8-6-11)14(16)17/h5-8,10H,3-4,9H2,1-2H3,(H,16,17)