cyclohexane; methyl benzoate; 2-[2-(phenylcarbonyloxy)propoxy]propyl benzoate

Systemtic Name: cyclohexane; methyl benzoate; 2-[2-(phenylcarbonyloxy)propoxy]propyl benzoate Openeye Name: 2-(2-benzoyloxypropoxy)propyl benzoate; cyclohexane; methyl benzoate CAS Name: benzoic acid 2-(2-benzoyloxypropoxy)propyl ester; benzoic acid methyl ester; cyclohexane IUPAC Name: 2-(2-benzoyloxypropoxy)propyl benzoate; cyclohexane; methyl benzoate Traditional Name: benzoic acid 2-(2-benzoyloxypropoxy)propyl ester; benzoic acid methyl ester; cyclohexane Formula: C42H50O9 MolecularWeight: 698.841

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(C)COC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2.COC(=O)C1=CC=CC=C1.COC(=O)C1=CC=CC=C1.C1CCCCC1

Isomeric SMILES

CC(COC(C)COC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2.COC(=O)C1=CC=CC=C1.COC(=O)C1=CC=CC=C1.C1CCCCC1

InChI

InChI=1S/C20H22O5.2C8H8O2.C6H12/c1-15(13-24-19(21)17-9-5-3-6-10-17)23-14-16(2)25-20(22)18-11-7-4-8-12-18;2*1-10-8(9)7-5-3-2-4-6-7;1-2-4-6-5-3-1/h3-12,15-16H,13-14H2,1-2H3;2*2-6H,1H3;1-6H2