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

Systemtic Name: [5,5-dimethyl-6-(phenylcarbonyloxy)nonan-4-yl] benzoate Openeye Name: (3-benzoyloxy-2,2-dimethyl-1-propyl-hexyl) benzoate CAS Name: benzoic acid (6-benzoyloxy-5,5-dimethylnonan-4-yl) ester IUPAC Name: (6-benzoyloxy-5,5-dimethylnonan-4-yl) benzoate Traditional Name: benzoic acid (3-benzoyloxy-2,2-dimethyl-1-propyl-hexyl) ester Formula: C25H32O4 MolecularWeight: 396.51918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32O4/c1-5-13-21(28-23(26)19-15-9-7-10-16-19)25(3,4)22(14-6-2)29-24(27)20-17-11-8-12-18-20/h7-12,15-18,21-22H,5-6,13-14H2,1-4H3