3-nonanoyloxy-4-phenyl-benzoic acid

Systemtic Name: 3-nonanoyloxy-4-phenyl-benzoic acid Openeye Name: 3-nonanoyloxy-4-phenyl-benzoic acid CAS Name: 3-(1-oxononoxy)-4-phenylbenzoic acid IUPAC Name: 3-nonanoyloxy-4-phenylbenzoic acid Traditional Name: 3-pelargonyloxy-4-phenyl-benzoic acid Formula: C22H26O4 MolecularWeight: 354.43944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=C(C=CC(=C1)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC(=O)OC1=C(C=CC(=C1)C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C22H26O4/c1-2-3-4-5-6-10-13-21(23)26-20-16-18(22(24)25)14-15-19(20)17-11-8-7-9-12-17/h7-9,11-12,14-16H,2-6,10,13H2,1H3,(H,24,25)