4-(4-hexanoylphenyl)carbonyloxybenzoic acid

Systemtic Name: 4-(4-hexanoylphenyl)carbonyloxybenzoic acid Openeye Name: 4-(4-hexanoylbenzoyl)oxybenzoic acid CAS Name: 4-[oxo-[4-(1-oxohexyl)phenyl]methoxy]benzoic acid IUPAC Name: 4-(4-hexanoylbenzoyl)oxybenzoic acid Traditional Name: 4-(4-caproylbenzoyl)oxybenzoic acid Formula: C20H20O5 MolecularWeight: 340.3698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCC(=O)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C20H20O5/c1-2-3-4-5-18(21)14-6-8-16(9-7-14)20(24)25-17-12-10-15(11-13-17)19(22)23/h6-13H,2-5H2,1H3,(H,22,23)