[5,5-diethyl-6-(phenylcarbonyloxy)nonan-4-yl] benzoate

Systemtic Name: [5,5-diethyl-6-(phenylcarbonyloxy)nonan-4-yl] benzoate Openeye Name: (3-benzoyloxy-2,2-diethyl-1-propyl-hexyl) benzoate CAS Name: benzoic acid (6-benzoyloxy-5,5-diethylnonan-4-yl) ester IUPAC Name: (6-benzoyloxy-5,5-diethylnonan-4-yl) benzoate Traditional Name: benzoic acid (3-benzoyloxy-2,2-diethyl-1-propyl-hexyl) ester Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)(CC)C(CCC)OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC(C(CC)(CC)C(CCC)OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C27H36O4/c1-5-15-23(30-25(28)21-17-11-9-12-18-21)27(7-3,8-4)24(16-6-2)31-26(29)22-19-13-10-14-20-22/h9-14,17-20,23-24H,5-8,15-16H2,1-4H3